2-[2-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-imidazol-1-yl-ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: 2-[2-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-imidazol-1-yl-ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: 2-[2-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-imidazol-1-yl-ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: 2-[2-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-(1-imidazolyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: 2-[2-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-imidazol-1-ylethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: [2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-imidazol-1-yl-ethyl]-(1-pyrrolin-2-yl)amine Formula: C15H24N6 MolecularWeight: 288.39126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)C(CNC2=NCCC2)N3C=CN=C3)N

Isomeric SMILES

C1CCC(=NC(C1)C(CNC2=NCCC2)N3C=CN=C3)N

InChI

InChI=1S/C15H24N6/c16-14-5-2-1-4-12(20-14)13(21-9-8-17-11-21)10-19-15-6-3-7-18-15/h8-9,11-13H,1-7,10H2,(H2,16,20)(H,18,19)