2-[[(5Z)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[[(5Z)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[(5Z)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[(5Z)-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[[(5Z)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[(5Z)-5-(6-ketocyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CSC1=NNC(=C2C=CC=CC2=O)N1CCC3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)CSC1=NN/C(=C\2/C=CC=CC2=O)/N1CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-2-13-22-19(27)15-28-21-24-23-20(17-10-6-7-11-18(17)26)25(21)14-12-16-8-4-3-5-9-16/h2-11,23H,1,12-15H2,(H,22,27)/b20-17+