3-[3-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]propyl]-1H-benzimidazol-2-one Formula: C20H26N6OS MolecularWeight: 398.52504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3CC3)SCCCN4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3CC3)SCCCN4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C20H26N6OS/c27-19-21-16-7-2-3-8-17(16)25(19)13-6-14-28-20-23-22-18(26(20)15-9-10-15)24-11-4-1-5-12-24/h2-3,7-8,15H,1,4-6,9-14H2,(H,21,27)