prop-2-ynyl 4-[4-[(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(6-methyl-5-oxo-3-thioxo-2H-1,2,4-triazin-4-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(5-keto-6-methyl-3-thioxo-2H-1,2,4-triazin-4-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C17H18N6O4S2 MolecularWeight: 434.49262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CC1=NNC(=S)N(C1=O)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C17H18N6O4S2/c1-3-8-27-17(26)22-6-4-11(5-7-22)14-18-12(9-29-14)13(24)21-23-15(25)10(2)19-20-16(23)28/h1,9,11H,4-8H2,2H3,(H,20,28)(H,21,24)