N-(4-aminocarbonylphenyl)-5-chloranyl-2-prop-2-enylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-5-chloranyl-2-prop-2-enylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 2-allylsulfanyl-N-(4-carbamoylphenyl)-5-chloro-pyrimidine-4-carboxamide CAS Name: N-(4-carbamoylphenyl)-5-chloro-2-(prop-2-enylthio)-4-pyrimidinecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-5-chloro-2-prop-2-enylsulfanylpyrimidine-4-carboxamide Traditional Name: 2-(allylthio)-N-(4-carbamoylphenyl)-5-chloro-pyrimidine-4-carboxamide Formula: C15H13ClN4O2S MolecularWeight: 348.80732

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)C(=O)N)Cl

Isomeric SMILES

C=CCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)C(=O)N)Cl

InChI

InChI=1S/C15H13ClN4O2S/c1-2-7-23-15-18-8-11(16)12(20-15)14(22)19-10-5-3-9(4-6-10)13(17)21/h2-6,8H,1,7H2,(H2,17,21)(H,19,22)