2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole Openeye Name: 6-nitro-2-[4-(p-tolylmethyl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[4-(4-methylbenzyl)piperazino]-6-nitro-1,3-benzothiazole Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O2S/c1-14-2-4-15(5-3-14)13-21-8-10-22(11-9-21)19-20-17-7-6-16(23(24)25)12-18(17)26-19/h2-7,12H,8-11,13H2,1H3