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

Systemtic Name: 2-[[3-chloranyl-4-(2-methylphenyl)carbothioyl-phenyl]amino]benzenecarbonitrile Openeye Name: 2-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]benzonitrile CAS Name: 2-[3-chloro-4-[(2-methylphenyl)-sulfanylidenemethyl]anilino]benzonitrile IUPAC Name: 2-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]benzonitrile Traditional Name: 2-[3-chloro-4-(2-methylthiobenzoyl)anilino]benzonitrile Formula: C21H15ClN2S MolecularWeight: 362.8752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=CC=CC=C3C#N)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=CC=CC=C3C#N)Cl

InChI

InChI=1S/C21H15ClN2S/c1-14-6-2-4-8-17(14)21(25)18-11-10-16(12-19(18)22)24-20-9-5-3-7-15(20)13-23/h2-12,24H,1H3