N-[2-[[3-chloranyl-4-(2-methylphenyl)carbothioyl-phenyl]amino]phenyl]octanamide

Systemtic Name: N-[2-[[3-chloranyl-4-(2-methylphenyl)carbothioyl-phenyl]amino]phenyl]octanamide Openeye Name: N-[2-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]phenyl]octanamide CAS Name: N-[2-[3-chloro-4-[(2-methylphenyl)-sulfanylidenemethyl]anilino]phenyl]octanamide IUPAC Name: N-[2-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]phenyl]octanamide Traditional Name: N-[2-[3-chloro-4-(2-methylthiobenzoyl)anilino]phenyl]caprylamide Formula: C28H31ClN2OS MolecularWeight: 479.07654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC=CC=C1NC2=CC(=C(C=C2)C(=S)C3=CC=CC=C3C)Cl

Isomeric SMILES

CCCCCCCC(=O)NC1=CC=CC=C1NC2=CC(=C(C=C2)C(=S)C3=CC=CC=C3C)Cl

InChI

InChI=1S/C28H31ClN2OS/c1-3-4-5-6-7-16-27(32)31-26-15-11-10-14-25(26)30-21-17-18-23(24(29)19-21)28(33)22-13-9-8-12-20(22)2/h8-15,17-19,30H,3-7,16H2,1-2H3,(H,31,32)