3-[1-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-[(1-cyclopropyl-2-imidazolyl)thio]-1-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[(1-cyclopropylimidazol-2-yl)thio]acetyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=CN=C2SCC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1CC1N2C=CN=C2SCC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C20H23N5O2S/c26-18(13-28-20-21-9-12-24(20)14-5-6-14)23-10-7-15(8-11-23)25-17-4-2-1-3-16(17)22-19(25)27/h1-4,9,12,14-15H,5-8,10-11,13H2,(H,22,27)