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

Systemtic Name: 7-methyl-4-(4-piperidin-1-ylsulfonylphenyl)carbonyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-methyl-4-[4-(1-piperidylsulfonyl)benzoyl]-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-methyl-4-[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-methyl-4-(4-piperidin-1-ylsulfonylbenzoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-methyl-4-(4-piperidinosulfonylbenzoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C26H27N3O4S2 MolecularWeight: 509.64028

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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)N5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C26H27N3O4S2/c1-18-7-12-22-21(16-18)25(23-6-5-15-34-23)29(17-24(30)27-22)26(31)19-8-10-20(11-9-19)35(32,33)28-13-3-2-4-14-28/h5-12,15-16,25H,2-4,13-14,17H2,1H3,(H,27,30)