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

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2-(methylthio)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methylsulfanyl-4-propylpyrimidine-5-carboxamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-2-(methylthio)-4-propyl-pyrimidine-5-carboxamide Formula: C23H33N5O2S MolecularWeight: 443.60542

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)OC)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)OC)SC

InChI

InChI=1S/C23H33N5O2S/c1-4-6-21-20(17-25-23(26-21)31-3)22(29)24-11-5-12-27-13-15-28(16-14-27)18-7-9-19(30-2)10-8-18/h7-10,17H,4-6,11-16H2,1-3H3,(H,24,29)