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

Systemtic Name: N-(2-bromophenyl)-3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-bromophenyl)propanamide CAS Name: N-(2-bromophenyl)-3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(2-bromophenyl)-3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]-N-(2-bromophenyl)propionamide Formula: C16H19BrN4O2S MolecularWeight: 411.31666

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C16H19BrN4O2S/c1-3-9-21-14(11-23-2)19-20-16(21)24-10-8-15(22)18-13-7-5-4-6-12(13)17/h3-7H,1,8-11H2,2H3,(H,18,22)