3-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylazepan-2-one

Systemtic Name: 3-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylazepan-2-one Openeye Name: 3-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylazepan-2-one CAS Name: 3-[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]-2-azepanone IUPAC Name: 3-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylazepan-2-one Traditional Name: 3-[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]azepan-2-one Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SC4CCCCNC4=O

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SC4CCCCNC4=O

InChI

InChI=1S/C20H21N3O2S/c1-25-15-11-9-14(10-12-15)23-17-7-3-2-6-16(17)22-20(23)26-18-8-4-5-13-21-19(18)24/h2-3,6-7,9-12,18H,4-5,8,13H2,1H3,(H,21,24)