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

Systemtic Name: 3,4-diethoxy-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: N-[4-[(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]thiazol-2-yl]-3,4-diethoxy-benzamide CAS Name: 3,4-diethoxy-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-thiazolyl]benzamide IUPAC Name: 3,4-diethoxy-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-[(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]thiazol-2-yl]-3,4-diethoxy-benzamide Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)CC3=NNC(=S)N3CC=C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)CC3=NNC(=S)N3CC=C)OCC

InChI

InChI=1S/C20H23N5O3S2/c1-4-9-25-17(23-24-20(25)29)11-14-12-30-19(21-14)22-18(26)13-7-8-15(27-5-2)16(10-13)28-6-3/h4,7-8,10,12H,1,5-6,9,11H2,2-3H3,(H,24,29)(H,21,22,26)