6-(4-chlorophenyl)sulfanyl-N4-(3-methoxyphenyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(4-chlorophenyl)sulfanyl-N4-(3-methoxyphenyl)pyrimidine-4,5-diamine Openeye Name: 6-(4-chlorophenyl)sulfanyl-N4-(3-methoxyphenyl)pyrimidine-4,5-diamine CAS Name: 6-[(4-chlorophenyl)thio]-N4-(3-methoxyphenyl)pyrimidine-4,5-diamine IUPAC Name: 6-(4-chlorophenyl)sulfanyl-4-N-(3-methoxyphenyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[(4-chlorophenyl)thio]pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C17H15ClN4OS MolecularWeight: 358.8452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)N

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C17H15ClN4OS/c1-23-13-4-2-3-12(9-13)22-16-15(19)17(21-10-20-16)24-14-7-5-11(18)6-8-14/h2-10H,19H2,1H3,(H,20,21,22)