6-(benzotriazol-1-yl)-N-(3-methylbutyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(benzotriazol-1-yl)-N-(3-methylbutyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-isopentyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-N-(3-methylbutyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-N-(3-methylbutyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-isoamyl-amine Formula: C15H17N7O2 MolecularWeight: 327.34118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C15H17N7O2/c1-10(2)7-8-16-14-13(22(23)24)15(18-9-17-14)21-12-6-4-3-5-11(12)19-20-21/h3-6,9-10H,7-8H2,1-2H3,(H,16,17,18)