[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-(2-thienyl)methanone CAS Name: [4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone IUPAC Name: [4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(4-mesylphenyl)-1,4-diazepan-1-yl]-(2-thienyl)methanone Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2CCCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2CCCN(CC2)C(=O)C3=CC=CS3

InChI

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