3-chloranyl-4-ethoxy-5-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: 3-chloranyl-4-ethoxy-5-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]-3-chloro-4-ethoxy-5-methoxy-benzamide CAS Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-5-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]-3-chloro-4-ethoxy-5-methoxy-benzamide Formula: C19H20ClN5O3S2 MolecularWeight: 465.9768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)OC

InChI

InChI=1S/C19H20ClN5O3S2/c1-5-7-25-16(23-24-19(25)29)15-10(3)21-18(30-15)22-17(26)11-8-12(20)14(28-6-2)13(9-11)27-4/h5,8-9H,1,6-7H2,2-4H3,(H,24,29)(H,21,22,26)