3-(6-azanylhexylamino)-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-(6-azanylhexylamino)-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(6-aminohexylamino)-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one CAS Name: 3-(6-aminohexylamino)-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(6-aminohexylamino)-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-(6-aminohexylamino)-6-(3,4-dimethylphenyl)-2H-1,2,4-triazin-5-one Formula: C17H25N5O MolecularWeight: 315.4133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=NC2=O)NCCCCCCN)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=NC2=O)NCCCCCCN)C

InChI

InChI=1S/C17H25N5O/c1-12-7-8-14(11-13(12)2)15-16(23)20-17(22-21-15)19-10-6-4-3-5-9-18/h7-8,11H,3-6,9-10,18H2,1-2H3,(H2,19,20,22,23)