1-(4-ethoxyphenyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(4-ethoxyphenyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propan-1-one Openeye Name: 2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-ethoxyphenyl)propan-1-one CAS Name: 1-(4-ethoxyphenyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-propanone IUPAC Name: 1-(4-ethoxyphenyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propan-1-one Traditional Name: 2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-p-phenetyl-propan-1-one Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(N2CC=C)C3=CC=CC=C3OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(N2CC=C)C3=CC=CC=C3OC

InChI

InChI=1S/C23H25N3O3S/c1-5-15-26-22(19-9-7-8-10-20(19)28-4)24-25-23(26)30-16(3)21(27)17-11-13-18(14-12-17)29-6-2/h5,7-14,16H,1,6,15H2,2-4H3