2-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide CAS Name: 2-[[4-(3,4-dimethylphenyl)-1-piperazinyl]methyl]-N-(3-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[4-(3,4-dimethylphenyl)piperazino]methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)CC3=NC(=CS3)C(=O)NCC4=CN=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CC3=NC(=CS3)C(=O)NCC4=CN=CC=C4)C

InChI

InChI=1S/C23H27N5OS/c1-17-5-6-20(12-18(17)2)28-10-8-27(9-11-28)15-22-26-21(16-30-22)23(29)25-14-19-4-3-7-24-13-19/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H,25,29)