N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrol-1-yl-3-thiophen-2-yl-propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrol-1-yl-3-thiophen-2-yl-propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrol-1-yl-3-(2-thienyl)propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1-pyrrolyl)-3-thiophen-2-ylpropanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrol-1-yl-3-thiophen-2-ylpropanamide Traditional Name: N-homoveratryl-3-pyrrol-1-yl-3-(2-thienyl)propionamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CC(C2=CC=CS2)N3C=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CC(C2=CC=CS2)N3C=CC=C3)OC

InChI

InChI=1S/C21H24N2O3S/c1-25-18-8-7-16(14-19(18)26-2)9-10-22-21(24)15-17(20-6-5-13-27-20)23-11-3-4-12-23/h3-8,11-14,17H,9-10,15H2,1-2H3,(H,22,24)