4-(4-ethanoylphenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 4-(4-ethanoylphenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]butanamide Openeye Name: 4-(4-acetylphenoxy)-N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]butanamide CAS Name: 4-(4-acetylphenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]butanamide IUPAC Name: 4-(4-acetylphenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-(4-acetylphenoxy)-N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]butyramide Formula: C21H23N5O3S2 MolecularWeight: 457.56902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCCOC2=CC=C(C=C2)C(=O)C)C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCCOC2=CC=C(C=C2)C(=O)C)C3=NNC(=S)N3CC=C

InChI

InChI=1S/C21H23N5O3S2/c1-4-11-26-19(24-25-21(26)30)18-13(2)22-20(31-18)23-17(28)6-5-12-29-16-9-7-15(8-10-16)14(3)27/h4,7-10H,1,5-6,11-12H2,2-3H3,(H,25,30)(H,22,23,28)