4-[[3-chloranyl-4-(2-methylphenyl)carbothioyl-phenyl]amino]-3-methyl-benzenecarbonitrile

Systemtic Name: 4-[[3-chloranyl-4-(2-methylphenyl)carbothioyl-phenyl]amino]-3-methyl-benzenecarbonitrile Openeye Name: 4-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]-3-methyl-benzonitrile CAS Name: 4-[3-chloro-4-[(2-methylphenyl)-sulfanylidenemethyl]anilino]-3-methylbenzonitrile IUPAC Name: 4-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]-3-methylbenzonitrile Traditional Name: 4-[3-chloro-4-(2-methylthiobenzoyl)anilino]-3-methyl-benzonitrile Formula: C22H17ClN2S MolecularWeight: 376.90178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=C(C=C(C=C3)C#N)C)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=C(C=C(C=C3)C#N)C)Cl

InChI

InChI=1S/C22H17ClN2S/c1-14-5-3-4-6-18(14)22(26)19-9-8-17(12-20(19)23)25-21-10-7-16(13-24)11-15(21)2/h3-12,25H,1-2H3