2-[2-(1,2,4-triazol-1-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: 2-[2-(1,2,4-triazol-1-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: 2-[2-(1,2,4-triazol-1-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: 2-[2-(1,2,4-triazol-1-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: 2-[2-(1,2,4-triazol-1-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: [2-[2-(1,2,4-triazol-1-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-yl]amine Formula: C10H17N5 MolecularWeight: 207.27548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CCN2C=NC=N2)N

Isomeric SMILES

C1CCC(=NC(C1)CCN2C=NC=N2)N

InChI

InChI=1S/C10H17N5/c11-10-4-2-1-3-9(14-10)5-6-15-8-12-7-13-15/h7-9H,1-6H2,(H2,11,14)