2-[1-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one

Systemtic Name: 2-[1-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one Openeye Name: 4-allyl-2-[1-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-5-(2-thienyl)-1,2,4-triazol-3-one CAS Name: 2-[1-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one IUPAC Name: 2-[1-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one Traditional Name: 4-allyl-2-[1-[4-(2-methoxyphenyl)piperazino]ethyl]-5-(2-thienyl)-1,2,4-triazol-3-one Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCN(CC1)C2=CC=CC=C2OC)N3C(=O)N(C(=N3)C4=CC=CS4)CC=C

Isomeric SMILES

CC(N1CCN(CC1)C2=CC=CC=C2OC)N3C(=O)N(C(=N3)C4=CC=CS4)CC=C

InChI

InChI=1S/C22H27N5O2S/c1-4-11-26-21(20-10-7-16-30-20)23-27(22(26)28)17(2)24-12-14-25(15-13-24)18-8-5-6-9-19(18)29-3/h4-10,16-17H,1,11-15H2,2-3H3