IUPAC: tert-butyl 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCCN(c2nc3ccccc3[nH]2)CC1Canonical SMILES:
CC(C)(C)OC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3N2分子式: C17H24N4O2
分子量: 316.40
InChIKey: QALNUAJVHGIFGO-UHFFFAOYSA-N
InChI:
PubChem CID: 18464655 →InChI=1S/C17H24N4O2/c1-17(2,3)23-16(22)21-10-6-9-20(11-12-21)15-18-13-7-4-5-8-14(13)19-15/h4-5,7-8H,6,9-12H2,1-3H3,(H,18,19)同義語
SCHEMBL3076747QALNUAJVHGIFGO-UHFFFAOYSA-N1-(t-butoxycarbonyl)-4-(1H-benzimidazol-2-yl)[1,4]diazepan1-(t-butoxycarbonyl)-4-(1H-benzimidazol-2-yl)[1,4]diazepane1-t-butoxycarbonyl-4-(1H-benzimidazol-2-yl)[1,4]diazepane4-(1H-benzoimidazol-2-yl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester