5-[(4-butan-2-yloxyphenyl)methyl]-3-(2-methylphenyl)-1,3,4-thiadiazol-2-one

Systemtic Name: 5-[(4-butan-2-yloxyphenyl)methyl]-3-(2-methylphenyl)-1,3,4-thiadiazol-2-one Openeye Name: 3-(o-tolyl)-5-[(4-sec-butoxyphenyl)methyl]-1,3,4-thiadiazol-2-one CAS Name: 5-[(4-butan-2-yloxyphenyl)methyl]-3-(2-methylphenyl)-1,3,4-thiadiazol-2-one IUPAC Name: 5-[(4-butan-2-yloxyphenyl)methyl]-3-(2-methylphenyl)-1,3,4-thiadiazol-2-one Traditional Name: 3-(o-tolyl)-5-(4-sec-butoxybenzyl)-1,3,4-thiadiazol-2-one Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)CC2=NN(C(=O)S2)C3=CC=CC=C3C

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)CC2=NN(C(=O)S2)C3=CC=CC=C3C

InChI

InChI=1S/C20H22N2O2S/c1-4-15(3)24-17-11-9-16(10-12-17)13-19-21-22(20(23)25-19)18-8-6-5-7-14(18)2/h5-12,15H,4,13H2,1-3H3