N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-pyrrol-1-yl-thiophene-2-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-pyrrol-1-yl-thiophene-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-pyrrol-1-yl-thiophene-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-3-(1-pyrrolyl)-2-thiophenecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-3-pyrrol-1-ylthiophene-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-3-pyrrol-1-yl-thiophene-2-carboxamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CS3)N4C=CC=C4)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CS3)N4C=CC=C4)C

InChI

InChI=1S/C22H26N4OS/c1-3-24-11-13-26(14-12-24)19-7-6-18(16-17(19)2)23-22(27)21-20(8-15-28-21)25-9-4-5-10-25/h4-10,15-16H,3,11-14H2,1-2H3,(H,23,27)