(1,5-dimethylpyrazol-3-yl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (1,5-dimethylpyrazol-3-yl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (1,5-dimethylpyrazol-3-yl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (1,5-dimethyl-3-pyrazolyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (1,5-dimethylpyrazol-3-yl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (1,5-dimethylpyrazol-3-yl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C17H18N6O3S MolecularWeight: 386.42822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O3S/c1-11-9-14(19-20(11)2)16(24)21-5-7-22(8-6-21)17-18-13-4-3-12(23(25)26)10-15(13)27-17/h3-4,9-10H,5-8H2,1-2H3