(2-thiophen-2-ylcyclopropyl)-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (2-thiophen-2-ylcyclopropyl)-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-yl]methanone Openeye Name: [2-(2-thienyl)cyclopropyl]-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methanone CAS Name: [4-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]-(2-thiophen-2-ylcyclopropyl)methanone IUPAC Name: (2-thiophen-2-ylcyclopropyl)-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methanone Traditional Name: [2-(2-thienyl)cyclopropyl]-[4-(3,4,5-trimethoxybenzoyl)piperazino]methanone Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4

InChI

InChI=1S/C22H26N2O5S/c1-27-17-11-14(12-18(28-2)20(17)29-3)21(25)23-6-8-24(9-7-23)22(26)16-13-15(16)19-5-4-10-30-19/h4-5,10-12,15-16H,6-9,13H2,1-3H3