4-[(3-chloranyl-4-methyl-phenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbaldehyde

Systemtic Name: 4-[(3-chloranyl-4-methyl-phenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbaldehyde Openeye Name: 4-(3-chloro-4-methyl-anilino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 4-(3-chloro-4-methylanilino)-2-(methylthio)-5-pyrimidinecarboxaldehyde IUPAC Name: 4-(3-chloro-4-methylanilino)-2-methylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 4-(3-chloro-4-methyl-anilino)-2-(methylthio)pyrimidine-5-carbaldehyde Formula: C13H12ClN3OS MolecularWeight: 293.77188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=NC=C2C=O)SC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=NC=C2C=O)SC)Cl

InChI

InChI=1S/C13H12ClN3OS/c1-8-3-4-10(5-11(8)14)16-12-9(7-18)6-15-13(17-12)19-2/h3-7H,1-2H3,(H,15,16,17)