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

Systemtic Name: 3-cyclohexyl-N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide Openeye Name: 3-cyclohexyl-N-(5-phenyl-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide CAS Name: 3-cyclohexyl-N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide IUPAC Name: 3-cyclohexyl-N-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide Traditional Name: 3-cyclohexyl-N-(5-phenyl-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl)propionamide Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC2C(=S)NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC2C(=S)NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3OS/c28-21(16-15-17-9-3-1-4-10-17)26-23-24(29)25-20-14-8-7-13-19(20)22(27-23)18-11-5-2-6-12-18/h2,5-8,11-14,17,23H,1,3-4,9-10,15-16H2,(H,25,29)(H,26,28)