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

Systemtic Name: N-aminocarbonyl-2-[[5-[(4-chloranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-propanamide CAS Name: N-carbamoyl-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[4-allyl-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-carbamoyl-propionamide Formula: C16H18ClN5O3S MolecularWeight: 395.86382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=C(N1CC=C)COC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=C(N1CC=C)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H18ClN5O3S/c1-3-8-22-13(9-25-12-6-4-11(17)5-7-12)20-21-16(22)26-10(2)14(23)19-15(18)24/h3-7,10H,1,8-9H2,2H3,(H3,18,19,23,24)