2-methylsulfanyl-4-phenyl-N-(3-propan-2-yloxypropyl)pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-4-phenyl-N-(3-propan-2-yloxypropyl)pyrimidine-5-carboxamide Openeye Name: N-(3-isopropoxypropyl)-2-methylsulfanyl-4-phenyl-pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-4-phenyl-N-(3-propan-2-yloxypropyl)-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-4-phenyl-N-(3-propan-2-yloxypropyl)pyrimidine-5-carboxamide Traditional Name: N-(3-isopropoxypropyl)-2-(methylthio)-4-phenyl-pyrimidine-5-carboxamide Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1=CN=C(N=C1C2=CC=CC=C2)SC

Isomeric SMILES

CC(C)OCCCNC(=O)C1=CN=C(N=C1C2=CC=CC=C2)SC

InChI

InChI=1S/C18H23N3O2S/c1-13(2)23-11-7-10-19-17(22)15-12-20-18(24-3)21-16(15)14-8-5-4-6-9-14/h4-6,8-9,12-13H,7,10-11H2,1-3H3,(H,19,22)