2-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-6-(propylsulfanylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-6-(propylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-6-(propylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[4-[(4-aminophenyl)methyl]-1-piperazinyl]-6-[(propylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-6-(propylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[4-(4-aminobenzyl)piperazino]-6-[(propylthio)methyl]-1H-pyrimidin-4-one Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCC1=CC(=O)N=C(N1)N2CCN(CC2)CC3=CC=C(C=C3)N

Isomeric SMILES

CCCSCC1=CC(=O)N=C(N1)N2CCN(CC2)CC3=CC=C(C=C3)N

InChI

InChI=1S/C19H27N5OS/c1-2-11-26-14-17-12-18(25)22-19(21-17)24-9-7-23(8-10-24)13-15-3-5-16(20)6-4-15/h3-6,12H,2,7-11,13-14,20H2,1H3,(H,21,22,25)