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

Systemtic Name: 2-[[3-chloranyl-4-(2-methylphenyl)carbothioyl-phenyl]amino]pyridine-3-carbonitrile Openeye Name: 2-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]pyridine-3-carbonitrile CAS Name: 2-[3-chloro-4-[(2-methylphenyl)-sulfanylidenemethyl]anilino]-3-pyridinecarbonitrile IUPAC Name: 2-[3-chloro-4-(2-methylbenzenecarbothioyl)anilino]pyridine-3-carbonitrile Traditional Name: 2-[3-chloro-4-(2-methylthiobenzoyl)anilino]nicotinonitrile Formula: C20H14ClN3S MolecularWeight: 363.86326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=C(C=CC=N3)C#N)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=C(C=CC=N3)C#N)Cl

InChI

InChI=1S/C20H14ClN3S/c1-13-5-2-3-7-16(13)19(25)17-9-8-15(11-18(17)21)24-20-14(12-22)6-4-10-23-20/h2-11H,1H3,(H,23,24)