이름: 4-{3-[4-(6-Chloro-4-methyl-1H-benzoimidazol-2-yl)-3-methyl-phenoxy]-propyl}-[1,4]diazepan-5-one
IUPAC: 4-[3-[4-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-3-methylphenoxy]propyl]-1,4-diazepan-5-one
SMILES:
Cc1cc(OCCCN2CCNCCC2=O)ccc1-c1nc2c(C)cc(Cl)cc2[nH]1Canonical SMILES:
CC1=CC(=CC2=C1N=C(N2)C3=C(C=C(C=C3)OCCCN4CCNCCC4=O)C)Cl분자식: C23H27ClN4O2
분자량: 426.90
InChIKey: HEOOSKRYIMADSF-UHFFFAOYSA-N
InChI:
PubChem CID: 59812216 →InChI=1S/C23H27ClN4O2/c1-15-13-18(30-11-3-9-28-10-8-25-7-6-21(28)29)4-5-19(15)23-26-20-14-17(24)12-16(2)22(20)27-23/h4-5,12-14,25H,3,6-11H2,1-2H3,(H,26,27)동의어
SCHEMBL601476HEOOSKRYIMADSF-UHFFFAOYSA-N4-{3-[4-(6-Chloro-4-methyl-1H-benzoimidazol-2-yl)-3-methyl-phenoxy]-propyl}-[1,4]diazepan-5-one