N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(4-methyl-5-piperonyl-thiazol-2-yl)-2-(methylthio)pyrimidine-4-carboxamide Formula: C18H15ClN4O3S2 MolecularWeight: 434.9197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=NC(=NC=C2Cl)SC)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=NC(=NC=C2Cl)SC)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15ClN4O3S2/c1-9-14(6-10-3-4-12-13(5-10)26-8-25-12)28-18(21-9)23-16(24)15-11(19)7-20-17(22-15)27-2/h3-5,7H,6,8H2,1-2H3,(H,21,23,24)