5-chloranyl-N-(4-ethoxyphenyl)-2-ethylsulfanyl-N-(phenylmethyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-ethoxyphenyl)-2-ethylsulfanyl-N-(phenylmethyl)pyrimidine-4-carboxamide Openeye Name: N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-ethylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-ethoxyphenyl)-2-(ethylthio)-N-(phenylmethyl)-4-pyrimidinecarboxamide IUPAC Name: N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-ethylsulfanylpyrimidine-4-carboxamide Traditional Name: N-benzyl-5-chloro-2-(ethylthio)-N-p-phenetyl-pyrimidine-4-carboxamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3=NC(=NC=C3Cl)SCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3=NC(=NC=C3Cl)SCC

InChI

InChI=1S/C22H22ClN3O2S/c1-3-28-18-12-10-17(11-13-18)26(15-16-8-6-5-7-9-16)21(27)20-19(23)14-24-22(25-20)29-4-2/h5-14H,3-4,15H2,1-2H3