(E)-3-(1,3-benzodioxol-5-yl)-N-(3-methylsulfanyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(3-methylsulfanyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[3-methylsulfanyl-5-(4-pyridyl)-1,2,4-triazol-4-yl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[3-(methylthio)-5-pyridin-4-yl-1,2,4-triazol-4-yl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(3-methylsulfanyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[3-(methylthio)-5-(4-pyridyl)-1,2,4-triazol-4-yl]acrylamide Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1NC(=O)C=CC2=CC3=C(C=C2)OCO3)C4=CC=NC=C4

Isomeric SMILES

CSC1=NN=C(N1NC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C4=CC=NC=C4

InChI

InChI=1S/C18H15N5O3S/c1-27-18-21-20-17(13-6-8-19-9-7-13)23(18)22-16(24)5-3-12-2-4-14-15(10-12)26-11-25-14/h2-10H,11H2,1H3,(H,22,24)/b5-3+