1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)carbonyl-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)carbonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-(4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carbonyl)-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-(4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carbonyl)-N-phenylpiperidine-3-carboxamide Traditional Name: 1-(4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carbonyl)-N-phenyl-nipecotamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3)N4C=CC=C4)C

InChI

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