N-cyclohexyl-2-[[5-(3,4-dimethoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cyclohexyl-2-[[5-(3,4-dimethoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-cyclohexyl-2-[[5-(3,4-dimethoxyphenyl)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-cyclohexyl-2-[[5-(3,4-dimethoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cyclohexyl-2-[[5-(3,4-dimethoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-cyclohexyl-2-[[5-(3,4-dimethoxyphenyl)-4-isopropyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC(C)C(=O)NC2CCCCC2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)N1C(=NN=C1SC(C)C(=O)NC2CCCCC2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H32N4O3S/c1-14(2)26-20(16-11-12-18(28-4)19(13-16)29-5)24-25-22(26)30-15(3)21(27)23-17-9-7-6-8-10-17/h11-15,17H,6-10H2,1-5H3,(H,23,27)