(5S)-8-chloranyl-5-phenyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: (5S)-8-chloranyl-5-phenyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: (5S)-8-chloro-5-phenyl-4-(4-pyrrolidin-1-ylsulfonylbenzoyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: (5S)-8-chloro-4-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: (5S)-8-chloro-5-phenyl-4-(4-pyrrolidin-1-ylsulfonylbenzoyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: (5S)-8-chloro-5-phenyl-4-(4-pyrrolidinosulfonylbenzoyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C26H24ClN3O4S MolecularWeight: 510.00446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CC(=O)NC4=C(C3C5=CC=CC=C5)C=CC(=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CC(=O)NC4=C([C@@H]3C5=CC=CC=C5)C=CC(=C4)Cl

InChI

InChI=1S/C26H24ClN3O4S/c27-20-10-13-22-23(16-20)28-24(31)17-30(25(22)18-6-2-1-3-7-18)26(32)19-8-11-21(12-9-19)35(33,34)29-14-4-5-15-29/h1-3,6-13,16,25H,4-5,14-15,17H2,(H,28,31)/t25-/m0/s1