[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-1-yl]-(3-methylphenyl)methanone

Systemtic Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-1-yl]-(3-methylphenyl)methanone Openeye Name: (4-indan-5-ylsulfonyl-1,4-diazepan-1-yl)-(m-tolyl)methanone CAS Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-1-yl]-(3-methylphenyl)methanone IUPAC Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-1-yl]-(3-methylphenyl)methanone Traditional Name: (4-indan-5-ylsulfonyl-1,4-diazepan-1-yl)-(m-tolyl)methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H26N2O3S/c1-17-5-2-8-20(15-17)22(25)23-11-4-12-24(14-13-23)28(26,27)21-10-9-18-6-3-7-19(18)16-21/h2,5,8-10,15-16H,3-4,6-7,11-14H2,1H3