N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide

Systemtic Name: N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide Openeye Name: N-(5-phenyl-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide CAS Name: N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide IUPAC Name: N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide Traditional Name: N-(5-phenyl-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl)propionamide Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1C(=S)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1C(=S)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS/c1-2-15(22)20-17-18(23)19-14-11-7-6-10-13(14)16(21-17)12-8-4-3-5-9-12/h3-11,17H,2H2,1H3,(H,19,23)(H,20,22)