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

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-[brosyl(methyl)amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C18H18BrN3O3S2 MolecularWeight: 468.38782

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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=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3O3S2/c1-22(27(24,25)13-8-6-12(19)7-9-13)11-17(23)21-18-15(10-20)14-4-2-3-5-16(14)26-18/h6-9H,2-5,11H2,1H3,(H,21,23)