4-[[1-(cyclohexylmethyl)-1,2,3-triazol-4-yl]carbonyl]-3-(phenylmethyl)piperazin-2-one

Systemtic Name: 4-[[1-(cyclohexylmethyl)-1,2,3-triazol-4-yl]carbonyl]-3-(phenylmethyl)piperazin-2-one Openeye Name: 3-benzyl-4-[1-(cyclohexylmethyl)triazole-4-carbonyl]piperazin-2-one CAS Name: 4-[[1-(cyclohexylmethyl)-4-triazolyl]-oxomethyl]-3-(phenylmethyl)-2-piperazinone IUPAC Name: 3-benzyl-4-[1-(cyclohexylmethyl)triazole-4-carbonyl]piperazin-2-one Traditional Name: 3-benzyl-4-[1-(cyclohexylmethyl)triazole-4-carbonyl]piperazin-2-one Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(N=N2)C(=O)N3CCNC(=O)C3CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CN2C=C(N=N2)C(=O)N3CCNC(=O)C3CC4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2/c27-20-19(13-16-7-3-1-4-8-16)26(12-11-22-20)21(28)18-15-25(24-23-18)14-17-9-5-2-6-10-17/h1,3-4,7-8,15,17,19H,2,5-6,9-14H2,(H,22,27)