4-[[3-(1,3-benzothiazol-2-yl)phenyl]amino]-3-nitro-benzamide

Systemtic Name: 4-[[3-(1,3-benzothiazol-2-yl)phenyl]amino]-3-nitro-benzamide Openeye Name: 4-[3-(1,3-benzothiazol-2-yl)anilino]-3-nitro-benzamide CAS Name: 4-[3-(1,3-benzothiazol-2-yl)anilino]-3-nitrobenzamide IUPAC Name: 4-[3-(1,3-benzothiazol-2-yl)anilino]-3-nitrobenzamide Traditional Name: 4-[3-(1,3-benzothiazol-2-yl)anilino]-3-nitro-benzamide Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4O3S/c21-19(25)12-8-9-15(17(11-12)24(26)27)22-14-5-3-4-13(10-14)20-23-16-6-1-2-7-18(16)28-20/h1-11,22H,(H2,21,25)