N-[2-(4-chloranyl-2-nitro-phenyl)sulfanylphenyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[2-(4-chloranyl-2-nitro-phenyl)sulfanylphenyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-(4-chloro-2-nitro-phenyl)sulfanylphenyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[(4-chloro-2-nitrophenyl)thio]phenyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-(4-chloro-2-nitrophenyl)sulfanylphenyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[(4-chloro-2-nitro-phenyl)thio]phenyl]-3,4-dimethyl-benzamide Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C21H17ClN2O3S/c1-13-7-8-15(11-14(13)2)21(25)23-17-5-3-4-6-19(17)28-20-10-9-16(22)12-18(20)24(26)27/h3-12H,1-2H3,(H,23,25)