2-[2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[(4-bromophenyl)sulfonyl-methyl-amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[(4-bromophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[(4-bromophenyl)sulfonyl-methylamino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[brosyl(methyl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C18H20BrN3O4S2 MolecularWeight: 486.4031

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrN3O4S2/c1-22(28(25,26)12-8-6-11(19)7-9-12)10-15(23)21-18-16(17(20)24)13-4-2-3-5-14(13)27-18/h6-9H,2-5,10H2,1H3,(H2,20,24)(H,21,23)