ethyl 3-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]pyrido[1,2-a]indole-10-carboxylate

Systemtic Name: ethyl 3-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]pyrido[1,2-a]indole-10-carboxylate Openeye Name: ethyl 3-[(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]pyrido[1,2-a]indole-10-carboxylate CAS Name: 3-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-10-pyrido[1,2-a]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]pyrido[1,2-a]indole-10-carboxylate Traditional Name: 3-[(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]pyrid[1,2-a]indole-10-carboxylic acid ethyl ester Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)COC2=CC3=C(C=C2)C(=C4N3C=CC=C4)C(=O)OCC

Isomeric SMILES

CCN1C(=NNC1=S)COC2=CC3=C(C=C2)C(=C4N3C=CC=C4)C(=O)OCC

InChI

InChI=1S/C20H20N4O3S/c1-3-23-17(21-22-20(23)28)12-27-13-8-9-14-16(11-13)24-10-6-5-7-15(24)18(14)19(25)26-4-2/h5-11H,3-4,12H2,1-2H3,(H,22,28)