(Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine

C19H17N3S — CID 75466690

IUPAC(Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine
SMILESC/C(=N/N=C(c1ccccc1)c1ccccc1)c1scnc1C
InChIInChI=1S/C19H17N3S/c1-14-19(23-13-20-14)15(2)21-22-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-13H,1-2H3/b21-15-
InChIKeySCJKVQOLNFQSCT-QNGOZBTKSA-N
MW319.43 g/mol
LogP4.71
Rot. Bonds4

About (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine

(Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine (PubChem CID 75466690) has the molecular formula C19H17N3S and a molecular weight of 319.43 g/mol. Its IUPAC name is (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine.

Molecular Properties

Compound Name(Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine
PubChem CID75466690
Molecular FormulaC19H17N3S
Molecular Weight319.43 g/mol
Exact Mass319.11
IUPAC Name(Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine
SMILESC/C(=N/N=C(c1ccccc1)c1ccccc1)c1scnc1C
InChIInChI=1S/C19H17N3S/c1-14-19(23-13-20-14)15(2)21-22-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-13H,1-2H3/b21-15-
InChIKeySCJKVQOLNFQSCT-QNGOZBTKSA-N
XLogP4.71
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.43
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[1-(4-methyl-1,3-thiazol-5-yl)ethylidenehydrazinylidene]-1,2-diphenylethanone
CID 126810323
2-[(2E)-2-[1-(4-methyl-1,3-thiazol-5-yl)ethylidene]hydrazinyl]benzoic acid
CID 95765462
2-[(E)-N-(benzhydrylideneamino)-C-methylcarbonimidoyl]phenol
CID 135775332
N-(benzhydrylideneamino)-1-(3,4-dimethylphenyl)ethanimine
CID 4649996
2-anilino-N-[(E)-1-(4-methyl-1,3-thiazol-5-yl)ethylideneamino]acetamide
CID 97002883
N'-(benzhydrylideneamino)ethanimidamide
CID 11128320
N-(benzhydrylideneamino)-N-methyl-4-(4-methyl-1,3-thiazol-5-yl)aniline
CID 177199460
N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine
CID 102116978
2-[(4-methyl-1,3-thiazole-5-carbonyl)amino]benzoic acid
CID 18071798
(E)-1-(4-methyl-1,3-thiazol-5-yl)-3-(4-phenylphenyl)prop-2-en-1-one
CID 169042143
4-methoxy-N-[1-(4-methyl-1,3-thiazol-5-yl)ethylideneamino]pyrimidin-2-amine
CID 71896567
4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline
CID 6871279

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine?
The IUPAC name of (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine (CID 75466690) is (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine.
What is the SMILES notation for (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine?
The canonical SMILES for (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine is C/C(=N/N=C(c1ccccc1)c1ccccc1)c1scnc1C.
What is the InChIKey of (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine?
The InChIKey is SCJKVQOLNFQSCT-QNGOZBTKSA-N. The full InChI is InChI=1S/C19H17N3S/c1-14-19(23-13-20-14)15(2)21-22-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-13H,1-2H3/b21-15-.
What are the key properties of (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine?
(Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine has a molecular weight of 319.43 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(benzhydrylideneamino)-1-(4-methyl-1,3-thiazol-5-yl)ethanimine is sourced from PubChem (CID 75466690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).