[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-(2-thiophen-2-ylcyclopropyl)methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-(2-thiophen-2-ylcyclopropyl)methanone Openeye Name: [4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-[2-(2-thienyl)cyclopropyl]methanone CAS Name: [4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-(2-thiophen-2-ylcyclopropyl)methanone IUPAC Name: [4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-(2-thiophen-2-ylcyclopropyl)methanone Traditional Name: [2-(2-thienyl)cyclopropyl]-(4-veratroylpiperazino)methanone Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4)OC

InChI

InChI=1S/C21H24N2O4S/c1-26-17-6-5-14(12-18(17)27-2)20(24)22-7-9-23(10-8-22)21(25)16-13-15(16)19-4-3-11-28-19/h3-6,11-12,15-16H,7-10,13H2,1-2H3