N-[(E)-[3-(1,3-benzothiazol-2-yl)pyrazol-4-ylidene]amino]-4-nitro-aniline

Systemtic Name: N-[(E)-[3-(1,3-benzothiazol-2-yl)pyrazol-4-ylidene]amino]-4-nitro-aniline Openeye Name: N-[(E)-[3-(1,3-benzothiazol-2-yl)pyrazol-4-ylidene]amino]-4-nitro-aniline CAS Name: N-[(E)-[3-(1,3-benzothiazol-2-yl)-4-pyrazolylidene]amino]-4-nitroaniline IUPAC Name: N-[(E)-[3-(1,3-benzothiazol-2-yl)pyrazol-4-ylidene]amino]-4-nitroaniline Traditional Name: [(E)-[3-(1,3-benzothiazol-2-yl)pyrazol-4-ylidene]amino]-(4-nitrophenyl)amine Formula: C16H10N6O2S MolecularWeight: 350.3546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=NN=CC3=NNC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C\3=NN=C/C3=N\NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H10N6O2S/c23-22(24)11-7-5-10(6-8-11)19-20-13-9-17-21-15(13)16-18-12-3-1-2-4-14(12)25-16/h1-9,19H/b20-13+