5-chloranyl-N-(4-ethoxyphenyl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-ethoxyphenyl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(4-ethoxyphenyl)-2-isopropylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-ethoxyphenyl)-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(4-ethoxyphenyl)-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(isopropylthio)-N-p-phenetyl-pyrimidine-4-carboxamide Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SC(C)C

InChI

InChI=1S/C16H18ClN3O2S/c1-4-22-12-7-5-11(6-8-12)19-15(21)14-13(17)9-18-16(20-14)23-10(2)3/h5-10H,4H2,1-3H3,(H,19,21)