3-methyl-N-(4-methylpiperazin-1-yl)-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide

Systemtic Name: 3-methyl-N-(4-methylpiperazin-1-yl)-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide Openeye Name: 3-methyl-N-(4-methylpiperazin-1-yl)-6-(3-nitrophenyl)imidazo[2,1-b]thiazole-2-carboxamide CAS Name: 3-methyl-N-(4-methyl-1-piperazinyl)-6-(3-nitrophenyl)-2-imidazo[2,1-b]thiazolecarboxamide IUPAC Name: 3-methyl-N-(4-methylpiperazin-1-yl)-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide Traditional Name: 3-methyl-N-(4-methylpiperazino)-6-(3-nitrophenyl)imidazo[2,1-b]thiazole-2-carboxamide Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=CN12)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NN4CCN(CC4)C

Isomeric SMILES

CC1=C(SC2=NC(=CN12)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NN4CCN(CC4)C

InChI

InChI=1S/C18H20N6O3S/c1-12-16(17(25)20-22-8-6-21(2)7-9-22)28-18-19-15(11-23(12)18)13-4-3-5-14(10-13)24(26)27/h3-5,10-11H,6-9H2,1-2H3,(H,20,25)