N-[(3S)-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3S)-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(3S)-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-3-piperidinosulfonyl-benzamide Formula: C27H26N4O4S MolecularWeight: 502.58474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N[C@@H]3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O4S/c32-26(20-12-9-13-21(18-20)36(34,35)31-16-7-2-8-17-31)30-25-27(33)28-23-15-6-5-14-22(23)24(29-25)19-10-3-1-4-11-19/h1,3-6,9-15,18,25H,2,7-8,16-17H2,(H,28,33)(H,30,32)/t25-/m1/s1