4-hexoxy-3-methoxy-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: 4-hexoxy-3-methoxy-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-hexoxy-3-methoxy-benzamide CAS Name: 4-hexoxy-3-methoxy-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzamide IUPAC Name: 4-hexoxy-3-methoxy-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-hexoxy-3-methoxy-benzamide Formula: C23H29N5O3S2 MolecularWeight: 487.63806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)OC

InChI

InChI=1S/C23H29N5O3S2/c1-5-7-8-9-13-31-17-11-10-16(14-18(17)30-4)21(29)25-22-24-15(3)19(33-22)20-26-27-23(32)28(20)12-6-2/h6,10-11,14H,2,5,7-9,12-13H2,1,3-4H3,(H,27,32)(H,24,25,29)