N-[(4-methoxyphenyl)methyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-p-anisyl-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=C(SC3=C2CCCC3)N4C=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=C(SC3=C2CCCC3)N4C=CC=C4

InChI

InChI=1S/C21H22N2O2S/c1-25-16-10-8-15(9-11-16)14-22-20(24)19-17-6-2-3-7-18(17)26-21(19)23-12-4-5-13-23/h4-5,8-13H,2-3,6-7,14H2,1H3,(H,22,24)