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

Systemtic Name: 3-methoxy-4-(3-methylbutoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-isopentyloxy-3-methoxy-benzamide CAS Name: 3-methoxy-4-(3-methylbutoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzamide IUPAC Name: 3-methoxy-4-(3-methylbutoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-isoamoxy-3-methoxy-benzamide Formula: C22H27N5O3S2 MolecularWeight: 473.61148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O3S2/c1-6-10-27-19(25-26-22(27)31)18-14(4)23-21(32-18)24-20(28)15-7-8-16(17(12-15)29-5)30-11-9-13(2)3/h6-8,12-13H,1,9-11H2,2-5H3,(H,26,31)(H,23,24,28)