hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate

C34H32N12O3S3 — CID 157360510

About hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate

hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate (PubChem CID 157360510) has the molecular formula C34H32N12O3S3 and a molecular weight of 752.91 g/mol. Its IUPAC name is hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate.

Molecular Properties

• Compound Name: hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate
• PubChem CID: 157360510
• Molecular Formula: C34H32N12O3S3
• Molecular Weight: 752.91 g/mol
• Exact Mass: 752.19
• IUPAC Name: hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate
• SMILES: Cc1nc(-c2cccnc2)sc1-c1cccc(-c2nccnn2)n1.Cc1nc(-c2cccnc2)sc1-c1cccc(C(N)=S)n1.NN.O.O=CC=O
• InChI: InChI=1S/C17H12N6S.C15H12N4S2.C2H2O2.H4N2.H2O/c1-11-15(24-17(21-11)12-4-3-7-18-10-12)13-5-2-6-14(22-13)16-19-8-9-20-23-16;1-9-13(11-5-2-6-12(19-11)14(16)20)21-15(18-9)10-4-3-7-17-8-10;3-1-2-4;1-2;/h2-10H,1H3;2-8H,1H3,(H2,16,20);1-2H;1-2H2;1H2
• InChIKey: AJUFPSYWJCQKRE-UHFFFAOYSA-N
• XLogP: 4.02
• TPSA: 259.71 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 16
• Rotatable Bonds: 7
• Heavy Atoms: 52
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	752.91
LogP ≤ 5	4.02
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate?

The IUPAC name of hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate (CID 157360510) is hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate.

What is the SMILES notation for hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate?

The canonical SMILES for hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate is Cc1nc(-c2cccnc2)sc1-c1cccc(-c2nccnn2)n1.Cc1nc(-c2cccnc2)sc1-c1cccc(C(N)=S)n1.NN.O.O=CC=O.

What is the InChIKey of hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate?

The InChIKey is AJUFPSYWJCQKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N6S.C15H12N4S2.C2H2O2.H4N2.H2O/c1-11-15(24-17(21-11)12-4-3-7-18-10-12)13-5-2-6-14(22-13)16-19-8-9-20-23-16;1-9-13(11-5-2-6-12(19-11)14(16)20)21-15(18-9)10-4-3-7-17-8-10;3-1-2-4;1-2;/h2-10H,1H3;2-8H,1H3,(H2,16,20);1-2H;1-2H2;1H2.

What are the key properties of hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate?

hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate has a molecular weight of 752.91 g/mol, XLogP of 4.02, 7 rotatable bonds, 3 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for hydrazine;6-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)pyridine-2-carbothioamide;4-methyl-2-pyridin-3-yl-5-[6-(1,2,4-triazin-3-yl)-2-pyridinyl]-1,3-thiazole;oxaldehyde;hydrate is sourced from PubChem (CID 157360510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).