7-methyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-methyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-methyl-4-(4-pyrrolidin-1-ylsulfonylbenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-methyl-4-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-methyl-4-(4-pyrrolidin-1-ylsulfonylbenzoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-methyl-4-(4-pyrrolidinosulfonylbenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H25N3O4S2/c1-17-6-11-21-20(15-17)24(22-5-4-14-33-22)28(16-23(29)26-21)25(30)18-7-9-19(10-8-18)34(31,32)27-12-2-3-13-27/h4-11,14-15,24H,2-3,12-13,16H2,1H3,(H,26,29)