N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidino]-4-keto-butyl]thiophene-3-carboxamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)CCCNC(=O)C3=CSC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)CCCNC(=O)C3=CSC=C3)OC

InChI

InChI=1S/C21H26N2O4S/c1-26-18-8-7-15(13-19(18)27-2)17-5-4-11-23(17)20(24)6-3-10-22-21(25)16-9-12-28-14-16/h7-9,12-14,17H,3-6,10-11H2,1-2H3,(H,22,25)