N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrol-1-yl-thiophene-2-carboxamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrol-1-yl-thiophene-2-carboxamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrol-1-yl-thiophene-2-carboxamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-(1-pyrrolyl)-2-thiophenecarboxamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-pyrrol-1-ylthiophene-2-carboxamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-3-pyrrol-1-yl-thiophene-2-carboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=C(C=CS2)N3C=CC=C3)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2=C(C=CS2)N3C=CC=C3)N4CCCC4

InChI

InChI=1S/C22H25N3O2S/c1-27-18-8-6-7-17(15-18)20(25-12-4-5-13-25)16-23-22(26)21-19(9-14-28-21)24-10-2-3-11-24/h2-3,6-11,14-15,20H,4-5,12-13,16H2,1H3,(H,23,26)