3-[4-(2-azanylethyl)piperazin-1-yl]-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[4-(2-azanylethyl)piperazin-1-yl]-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[4-(2-aminoethyl)piperazin-1-yl]-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[4-(2-aminoethyl)-1-piperazinyl]-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[4-(2-aminoethyl)piperazin-1-yl]-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[4-(2-aminoethyl)piperazino]-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one Formula: C17H24N6O MolecularWeight: 328.41206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=NC2=O)N3CCN(CC3)CCN)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=NC2=O)N3CCN(CC3)CCN)C

InChI

InChI=1S/C17H24N6O/c1-12-3-4-14(11-13(12)2)15-16(24)19-17(21-20-15)23-9-7-22(6-5-18)8-10-23/h3-4,11H,5-10,18H2,1-2H3,(H,19,21,24)