4-methylsulfonyl-7-phenyl-3-(phenylmethyl)-3,5-dihydro-1H-pyrido[3,2-e][1,4]diazepin-2-one

Systemtic Name: 4-methylsulfonyl-7-phenyl-3-(phenylmethyl)-3,5-dihydro-1H-pyrido[3,2-e][1,4]diazepin-2-one Openeye Name: 3-benzyl-4-methylsulfonyl-7-phenyl-3,5-dihydro-1H-pyrido[3,2-e][1,4]diazepin-2-one CAS Name: 4-methylsulfonyl-7-phenyl-3-(phenylmethyl)-3,5-dihydro-1H-pyrido[3,2-e][1,4]diazepin-2-one IUPAC Name: 3-benzyl-4-methylsulfonyl-7-phenyl-3,5-dihydro-1H-pyrido[3,2-e][1,4]diazepin-2-one Traditional Name: 3-benzyl-4-mesyl-7-phenyl-3,5-dihydro-1H-pyrido[3,2-e][1,4]diazepin-2-one Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=C(C=CC(=N2)C3=CC=CC=C3)NC(=O)C1CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CC2=C(C=CC(=N2)C3=CC=CC=C3)NC(=O)C1CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-29(27,28)25-15-20-19(13-12-18(23-20)17-10-6-3-7-11-17)24-22(26)21(25)14-16-8-4-2-5-9-16/h2-13,21H,14-15H2,1H3,(H,24,26)