N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-[4-[4-(2-acetamidoethyl)phenyl]-2-thiazolyl]-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-5-chloro-2-(methylthio)pyrimidine-4-carboxamide Formula: C19H18ClN5O2S2 MolecularWeight: 447.96152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C19H18ClN5O2S2/c1-11(26)21-8-7-12-3-5-13(6-4-12)15-10-29-19(23-15)25-17(27)16-14(20)9-22-18(24-16)28-2/h3-6,9-10H,7-8H2,1-2H3,(H,21,26)(H,23,25,27)