N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-(2,5-dimethoxybenzyl)piperazino]-3-keto-propyl]thiophene-2-carboxamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)CCNC(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C21H27N3O4S/c1-27-17-5-6-18(28-2)16(14-17)15-23-9-11-24(12-10-23)20(25)7-8-22-21(26)19-4-3-13-29-19/h3-6,13-14H,7-12,15H2,1-2H3,(H,22,26)