N-[3-(benzimidazol-1-yl)propyl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-5-chloro-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H16ClN5OS MolecularWeight: 361.84914

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCCCN2C=NC3=CC=CC=C32)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCCCN2C=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C16H16ClN5OS/c1-24-16-19-9-11(17)14(21-16)15(23)18-7-4-8-22-10-20-12-5-2-3-6-13(12)22/h2-3,5-6,9-10H,4,7-8H2,1H3,(H,18,23)