N-[3-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-3-oxidanylidene-propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]amino]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]amino]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-keto-3-[[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]amino]propyl]thiophene-2-carboxamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CCNC(=O)C2=CC=CS2)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)CCNC(=O)C2=CC=CS2)N3CCCC3

InChI

InChI=1S/C21H27N3O3S/c1-27-17-7-4-6-16(14-17)18(24-11-2-3-12-24)15-23-20(25)9-10-22-21(26)19-8-5-13-28-19/h4-8,13-14,18H,2-3,9-12,15H2,1H3,(H,22,26)(H,23,25)