N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-2-(2-oxidanylidenechromen-7-yl)oxy-ethanamide

Systemtic Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-2-(2-oxidanylidenechromen-7-yl)oxy-ethanamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(2-oxochromen-7-yl)oxy-acetamide CAS Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]-2-[(2-oxo-1-benzopyran-7-yl)oxy]acetamide IUPAC Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-2-(2-oxochromen-7-yl)oxyacetamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(2-ketochromen-7-yl)oxy-acetamide Formula: C20H17N5O4S2 MolecularWeight: 455.51008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)C4=NNC(=S)N4CC=C

InChI

InChI=1S/C20H17N5O4S2/c1-3-8-25-18(23-24-20(25)30)17-11(2)21-19(31-17)22-15(26)10-28-13-6-4-12-5-7-16(27)29-14(12)9-13/h3-7,9H,1,8,10H2,2H3,(H,24,30)(H,21,22,26)