N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[methyl(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[methyl(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[benzenesulfonyl(methyl)amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: 2-[benzenesulfonyl(methyl)amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: 2-[benzenesulfonyl(methyl)amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-[besyl(methyl)amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=C(C2=C(S1)CCCC2)C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NC1=C(C2=C(S1)CCCC2)C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19N3O3S2/c1-21(26(23,24)13-7-3-2-4-8-13)12-17(22)20-18-15(11-19)14-9-5-6-10-16(14)25-18/h2-4,7-8H,5-6,9-10,12H2,1H3,(H,20,22)