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

Systemtic Name: 5-chloranyl-N-(phenylmethyl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-benzyl-5-chloro-2-isopropylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(phenylmethyl)-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: N-benzyl-5-chloro-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: N-benzyl-5-chloro-2-(isopropylthio)pyrimidine-4-carboxamide Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)NCC2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)NCC2=CC=CC=C2)Cl

InChI

InChI=1S/C15H16ClN3OS/c1-10(2)21-15-18-9-12(16)13(19-15)14(20)17-8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,17,20)