4-(1,3-thiazol-2-ylmethyl)-N-(2,4,5-trimethylphenyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: 4-(1,3-thiazol-2-ylmethyl)-N-(2,4,5-trimethylphenyl)-1,4-diazepane-1-carbothioamide Openeye Name: 4-(thiazol-2-ylmethyl)-N-(2,4,5-trimethylphenyl)-1,4-diazepane-1-carbothioamide CAS Name: 4-(2-thiazolylmethyl)-N-(2,4,5-trimethylphenyl)-1,4-diazepane-1-carbothioamide IUPAC Name: 4-(1,3-thiazol-2-ylmethyl)-N-(2,4,5-trimethylphenyl)-1,4-diazepane-1-carbothioamide Traditional Name: 4-(thiazol-2-ylmethyl)-N-(2,4,5-trimethylphenyl)-1,4-diazepane-1-carbothioamide Formula: C19H26N4S2 MolecularWeight: 374.56654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=S)N2CCCN(CC2)CC3=NC=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=S)N2CCCN(CC2)CC3=NC=CS3)C

InChI

InChI=1S/C19H26N4S2/c1-14-11-16(3)17(12-15(14)2)21-19(24)23-7-4-6-22(8-9-23)13-18-20-5-10-25-18/h5,10-12H,4,6-9,13H2,1-3H3,(H,21,24)