3-methyl-5-[(4-methylpiperazin-1-yl)-(3-nitrophenyl)methyl]-1,2-thiazole

Systemtic Name: 3-methyl-5-[(4-methylpiperazin-1-yl)-(3-nitrophenyl)methyl]-1,2-thiazole Openeye Name: 3-methyl-5-[(4-methylpiperazin-1-yl)-(3-nitrophenyl)methyl]isothiazole CAS Name: 3-methyl-5-[(4-methyl-1-piperazinyl)-(3-nitrophenyl)methyl]isothiazole IUPAC Name: 3-methyl-5-[(4-methylpiperazin-1-yl)-(3-nitrophenyl)methyl]-1,2-thiazole Traditional Name: 3-methyl-5-[(4-methylpiperazino)-(3-nitrophenyl)methyl]isothiazole Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1)C(C2=CC(=CC=C2)[N+](=O)[O-])N3CCN(CC3)C

Isomeric SMILES

CC1=NSC(=C1)C(C2=CC(=CC=C2)[N+](=O)[O-])N3CCN(CC3)C

InChI

InChI=1S/C16H20N4O2S/c1-12-10-15(23-17-12)16(19-8-6-18(2)7-9-19)13-4-3-5-14(11-13)20(21)22/h3-5,10-11,16H,6-9H2,1-2H3