[2-chloranyl-4-(pyrimidin-2-ylamino)phenyl]-(2-methylphenyl)methanethione

Systemtic Name: [2-chloranyl-4-(pyrimidin-2-ylamino)phenyl]-(2-methylphenyl)methanethione Openeye Name: [2-chloro-4-(pyrimidin-2-ylamino)phenyl]-(o-tolyl)methanethione CAS Name: [2-chloro-4-(2-pyrimidinylamino)phenyl]-(2-methylphenyl)methanethione IUPAC Name: [2-chloro-4-(pyrimidin-2-ylamino)phenyl]-(2-methylphenyl)methanethione Traditional Name: [2-chloro-4-(2-pyrimidylamino)phenyl]-(o-tolyl)methanethione Formula: C18H14ClN3S MolecularWeight: 339.84186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN3S/c1-12-5-2-3-6-14(12)17(23)15-8-7-13(11-16(15)19)22-18-20-9-4-10-21-18/h2-11H,1H3,(H,20,21,22)