2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide

Systemtic Name: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide Openeye Name: N-(2-isopropylpyrazol-3-yl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]-N-(2-propan-2-yl-3-pyrazolyl)propanamide IUPAC Name: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide Traditional Name: N-(2-isopropylpyrazol-3-yl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]propionamide Formula: C17H19N5OS3 MolecularWeight: 405.56066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NN(C(=S)S2)C3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NN(C(=S)S2)C3=CC=CC=C3

InChI

InChI=1S/C17H19N5OS3/c1-11(2)21-14(9-10-18-21)19-15(23)12(3)25-16-20-22(17(24)26-16)13-7-5-4-6-8-13/h4-12H,1-3H3,(H,19,23)