N-[5-nitro-1-(phenylcarbonyl)-2,1-benzothiazol-3-ylidene]benzamide

Systemtic Name: N-[5-nitro-1-(phenylcarbonyl)-2,1-benzothiazol-3-ylidene]benzamide Openeye Name: N-(1-benzoyl-5-nitro-2,1-benzothiazol-3-ylidene)benzamide CAS Name: N-(1-benzoyl-5-nitro-2,1-benzothiazol-3-ylidene)benzamide IUPAC Name: N-(1-benzoyl-5-nitro-2,1-benzothiazol-3-ylidene)benzamide Traditional Name: N-(1-benzoyl-5-nitro-2,1-benzothiazol-3-ylidene)benzamide Formula: C21H13N3O4S MolecularWeight: 403.41062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N=C2C3=C(C=CC(=C3)[N+](=O)[O-])N(S2)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N=C2C3=C(C=CC(=C3)[N+](=O)[O-])N(S2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H13N3O4S/c25-19(14-7-3-1-4-8-14)22-20-17-13-16(24(27)28)11-12-18(17)23(29-20)21(26)15-9-5-2-6-10-15/h1-13H