(2S)-N-methyl-N-[2-[(4S)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethyl]-2-phenyl-2-phenylsulfanyl-ethanamide

Systemtic Name: (2S)-N-methyl-N-[2-[(4S)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethyl]-2-phenyl-2-phenylsulfanyl-ethanamide Openeye Name: (2S)-N-methyl-N-[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxo-ethyl]-2-phenyl-2-phenylsulfanyl-acetamide CAS Name: (2S)-N-methyl-N-[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]-2-phenyl-2-(phenylthio)acetamide IUPAC Name: (2S)-N-methyl-N-[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]-2-phenyl-2-phenylsulfanylacetamide Traditional Name: (2S)-N-[2-keto-2-[(4S)-2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl]-N-methyl-2-phenyl-2-(phenylthio)acetamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)C(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)C(=O)[C@H](C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S/c1-19-17-24(31)28-22-15-9-10-16-23(22)30(19)25(32)18-29(2)27(33)26(20-11-5-3-6-12-20)34-21-13-7-4-8-14-21/h3-16,19,26H,17-18H2,1-2H3,(H,28,31)/t19-,26-/m0/s1