2-[(2-methylphenyl)carbonylamino]-N-[3-(4-methylpiperazin-1-yl)propyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(2-methylphenyl)carbonylamino]-N-[3-(4-methylpiperazin-1-yl)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(2-methylbenzoyl)amino]-N-[3-(4-methylpiperazin-1-yl)propyl]thiazole-4-carboxamide CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]-N-[3-(4-methyl-1-piperazinyl)propyl]-4-thiazolecarboxamide IUPAC Name: 2-[(2-methylbenzoyl)amino]-N-[3-(4-methylpiperazin-1-yl)propyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[3-(4-methylpiperazino)propyl]-2-(o-toluoylamino)thiazole-4-carboxamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC(=CS2)C(=O)NCCCN3CCN(CC3)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC(=CS2)C(=O)NCCCN3CCN(CC3)C

InChI

InChI=1S/C20H27N5O2S/c1-15-6-3-4-7-16(15)18(26)23-20-22-17(14-28-20)19(27)21-8-5-9-25-12-10-24(2)11-13-25/h3-4,6-7,14H,5,8-13H2,1-2H3,(H,21,27)(H,22,23,26)