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

Systemtic Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide Openeye Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide CAS Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide Traditional Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]-N-(2-nitrophenyl)propionamide Formula: C16H19N5O4S MolecularWeight: 377.41816

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4S/c1-3-9-20-14(11-25-2)18-19-16(20)26-10-8-15(22)17-12-6-4-5-7-13(12)21(23)24/h3-7H,1,8-11H2,2H3,(H,17,22)