N-(3-chlorophenyl)-4-(phenylmethyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-4-(phenylmethyl)-1,4-diazepane-1-carbothioamide Openeye Name: 4-benzyl-N-(3-chlorophenyl)-1,4-diazepane-1-carbothioamide CAS Name: N-(3-chlorophenyl)-4-(phenylmethyl)-1,4-diazepane-1-carbothioamide IUPAC Name: 4-benzyl-N-(3-chlorophenyl)-1,4-diazepane-1-carbothioamide Traditional Name: 4-benzyl-N-(3-chlorophenyl)-1,4-diazepane-1-carbothioamide Formula: C19H22ClN3S MolecularWeight: 359.91608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=S)NC2=CC(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=S)NC2=CC(=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN3S/c20-17-8-4-9-18(14-17)21-19(24)23-11-5-10-22(12-13-23)15-16-6-2-1-3-7-16/h1-4,6-9,14H,5,10-13,15H2,(H,21,24)