4-[1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-4-yl]-2-(2-piperidin-1-ylethyl)-1,2,4-triazol-3-one

Systemtic Name: 4-[1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-4-yl]-2-(2-piperidin-1-ylethyl)-1,2,4-triazol-3-one Openeye Name: 4-[1-[(E)-2-methyl-3-phenyl-allyl]-4-piperidyl]-2-[2-(1-piperidyl)ethyl]-1,2,4-triazol-3-one CAS Name: 4-[1-[(E)-2-methyl-3-phenylprop-2-enyl]-4-piperidinyl]-2-[2-(1-piperidinyl)ethyl]-1,2,4-triazol-3-one IUPAC Name: 4-[1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-4-yl]-2-(2-piperidin-1-ylethyl)-1,2,4-triazol-3-one Traditional Name: 4-[1-[(E)-2-methyl-3-phenyl-allyl]-4-piperidyl]-2-(2-piperidinoethyl)-1,2,4-triazol-3-one Formula: C24H35N5O MolecularWeight: 409.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN2CCC(CC2)N3C=NN(C3=O)CCN4CCCCC4

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/CN2CCC(CC2)N3C=NN(C3=O)CCN4CCCCC4

InChI

InChI=1S/C24H35N5O/c1-21(18-22-8-4-2-5-9-22)19-27-14-10-23(11-15-27)28-20-25-29(24(28)30)17-16-26-12-6-3-7-13-26/h2,4-5,8-9,18,20,23H,3,6-7,10-17,19H2,1H3/b21-18+