N-cyclohexyl-2-[[5-[(4-methoxyphenyl)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cyclohexyl-2-[[5-[(4-methoxyphenyl)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-propanamide CAS Name: N-cyclohexyl-2-[[5-[(4-methoxyphenyl)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cyclohexyl-2-[[5-[(4-methoxyphenyl)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-p-anisyl-1,2,4-triazol-3-yl)thio]-N-cyclohexyl-propionamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)SC2=NN=C(N2CC=C)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NC1CCCCC1)SC2=NN=C(N2CC=C)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N4O2S/c1-4-14-26-20(15-17-10-12-19(28-3)13-11-17)24-25-22(26)29-16(2)21(27)23-18-8-6-5-7-9-18/h4,10-13,16,18H,1,5-9,14-15H2,2-3H3,(H,23,27)