N-(4-chlorophenyl)-5-nitro-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]benzamide

Systemtic Name: N-(4-chlorophenyl)-5-nitro-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]benzamide Openeye Name: N-(4-chlorophenyl)-5-nitro-2-(1-phenyltetrazol-5-yl)sulfanyl-benzamide CAS Name: N-(4-chlorophenyl)-5-nitro-2-[(1-phenyl-5-tetrazolyl)thio]benzamide IUPAC Name: N-(4-chlorophenyl)-5-nitro-2-(1-phenyltetrazol-5-yl)sulfanylbenzamide Traditional Name: N-(4-chlorophenyl)-5-nitro-2-[(1-phenyltetrazol-5-yl)thio]benzamide Formula: C20H13ClN6O3S MolecularWeight: 452.87362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H13ClN6O3S/c21-13-6-8-14(9-7-13)22-19(28)17-12-16(27(29)30)10-11-18(17)31-20-23-24-25-26(20)15-4-2-1-3-5-15/h1-12H,(H,22,28)