N-(1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)sulfanyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)sulfanyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)sulfanyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[(4-nitrophenyl)thio]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)sulfanylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[(4-nitrophenyl)thio]benzamide Formula: C20H13N3O3S2 MolecularWeight: 407.46552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H13N3O3S2/c24-19(22-20-21-17-6-1-2-7-18(17)28-20)13-4-3-5-16(12-13)27-15-10-8-14(9-11-15)23(25)26/h1-12H,(H,21,22,24)