N-[3-(4-dimethylaminophenyl)propyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide

Systemtic Name: N-[3-(4-dimethylaminophenyl)propyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[3-(4-dimethylaminophenyl)propyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[3-(4-dimethylaminophenyl)propyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[3-(4-dimethylaminophenyl)propyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[3-(4-dimethylaminophenyl)propyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C21H30N4OS/c1-15-19(16(2)24-21(23-15)27-5)12-13-20(26)22-14-6-7-17-8-10-18(11-9-17)25(3)4/h8-11H,6-7,12-14H2,1-5H3,(H,22,26)