(3-methylphenyl)-(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (3-methylphenyl)-(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methanone Openeye Name: m-tolyl-[4-(2-thienylsulfonyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-methylphenyl)-(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methanone IUPAC Name: (3-methylphenyl)-(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methanone Traditional Name: m-tolyl-[4-(2-thienylsulfonyl)-1,4-diazepan-1-yl]methanone Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H20N2O3S2/c1-14-5-2-6-15(13-14)17(20)18-8-4-9-19(11-10-18)24(21,22)16-7-3-12-23-16/h2-3,5-7,12-13H,4,8-11H2,1H3