2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide

C76H68N22O13S4 — CID 157052624

About 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide

2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide (PubChem CID 157052624) has the molecular formula C76H68N22O13S4 and a molecular weight of 1625.79 g/mol. Its IUPAC name is 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide.

Molecular Properties

• Compound Name: 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide
• PubChem CID: 157052624
• Molecular Formula: C76H68N22O13S4
• Molecular Weight: 1625.79 g/mol
• Exact Mass: 1624.42
• IUPAC Name: 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide
• SMILES: CC(=O)Nc1cc(S(C)(=O)=O)ccc1C(=O)Nc1nc(C)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(CS(C)(=O)=O)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(S(=O)(=O)c3ccccc3)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(S(C)(=O)=O)cc2N)nc(-c2ccccn2)n1
• InChI: InChI=1S/C22H17N5O3S.C19H18N6O4S.C18H17N5O3S.C17H16N6O3S/c1-15-24-20(19-9-5-6-14-23-19)26-22(25-15)27-21(28)16-10-12-18(13-11-16)31(29,30)17-7-3-2-4-8-17;1-11-21-17(15-6-4-5-9-20-15)24-19(22-11)25-18(27)14-8-7-13(30(3,28)29)10-16(14)23-12(2)26;1-12-20-16(15-5-3-4-10-19-15)22-18(21-12)23-17(24)14-8-6-13(7-9-14)11-27(2,25)26;1-10-20-15(14-5-3-4-8-19-14)22-17(21-10)23-16(24)12-7-6-11(9-13(12)18)27(2,25)26/h2-14H,1H3,(H,24,25,26,27,28);4-10H,1-3H3,(H,23,26)(H,21,22,24,25,27);3-10H,11H2,1-2H3,(H,20,21,22,23,24);3-9H,18H2,1-2H3,(H,20,21,22,23,24)
• InChIKey: AAJRVSJRUUHYAB-UHFFFAOYSA-N
• XLogP: 8.70
• TPSA: 514.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 19
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1625.79
LogP ≤ 5	8.70
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide?

The IUPAC name of 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide (CID 157052624) is 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide.

What is the SMILES notation for 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide?

The canonical SMILES for 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide is CC(=O)Nc1cc(S(C)(=O)=O)ccc1C(=O)Nc1nc(C)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(CS(C)(=O)=O)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(S(=O)(=O)c3ccccc3)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(S(C)(=O)=O)cc2N)nc(-c2ccccn2)n1.

What is the InChIKey of 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide?

The InChIKey is AAJRVSJRUUHYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O3S.C19H18N6O4S.C18H17N5O3S.C17H16N6O3S/c1-15-24-20(19-9-5-6-14-23-19)26-22(25-15)27-21(28)16-10-12-18(13-11-16)31(29,30)17-7-3-2-4-8-17;1-11-21-17(15-6-4-5-9-20-15)24-19(22-11)25-18(27)14-8-7-13(30(3,28)29)10-16(14)23-12(2)26;1-12-20-16(15-5-3-4-10-19-15)22-18(21-12)23-17(24)14-8-6-13(7-9-14)11-27(2,25)26;1-10-20-15(14-5-3-4-8-19-14)22-17(21-10)23-16(24)12-7-6-11(9-13(12)18)27(2,25)26/h2-14H,1H3,(H,24,25,26,27,28);4-10H,1-3H3,(H,23,26)(H,21,22,24,25,27);3-10H,11H2,1-2H3,(H,20,21,22,23,24);3-9H,18H2,1-2H3,(H,20,21,22,23,24).

What are the key properties of 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide?

2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide has a molecular weight of 1625.79 g/mol, XLogP of 8.70, 19 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-acetamido-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-amino-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;4-(benzenesulfonyl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(methylsulfonylmethyl)benzamide is sourced from PubChem (CID 157052624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).