N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[2-(2-ethylanilino)-2-oxo-ethyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[2-(2-ethylanilino)-2-oxoethyl]-2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[2-(2-ethylanilino)-2-oxoethyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C2=C(SC3=C2CCCC3)N4C=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C2=C(SC3=C2CCCC3)N4C=CC=C4

InChI

InChI=1S/C23H25N3O2S/c1-2-16-9-3-5-11-18(16)25-20(27)15-24-22(28)21-17-10-4-6-12-19(17)29-23(21)26-13-7-8-14-26/h3,5,7-9,11,13-14H,2,4,6,10,12,15H2,1H3,(H,24,28)(H,25,27)