5-chloranyl-N-(4-methoxyphenyl)-N-(phenylmethyl)-2-propylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-methoxyphenyl)-N-(phenylmethyl)-2-propylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-benzyl-5-chloro-N-(4-methoxyphenyl)-2-propylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-methoxyphenyl)-N-(phenylmethyl)-2-(propylthio)-4-pyrimidinecarboxamide IUPAC Name: N-benzyl-5-chloro-N-(4-methoxyphenyl)-2-propylsulfanylpyrimidine-4-carboxamide Traditional Name: N-benzyl-5-chloro-N-(4-methoxyphenyl)-2-(propylthio)pyrimidine-4-carboxamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C22H22ClN3O2S/c1-3-13-29-22-24-14-19(23)20(25-22)21(27)26(15-16-7-5-4-6-8-16)17-9-11-18(28-2)12-10-17/h4-12,14H,3,13,15H2,1-2H3