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

Systemtic Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)propanamide Openeye Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)propanamide CAS Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-(3-methoxyphenyl)propanamide IUPAC Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)propanamide Traditional Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]-N-(3-methoxyphenyl)propionamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C17H22N4O3S/c1-4-9-21-15(12-23-2)19-20-17(21)25-10-8-16(22)18-13-6-5-7-14(11-13)24-3/h4-7,11H,1,8-10,12H2,2-3H3,(H,18,22)