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

Systemtic Name: N-(2-butan-2-ylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: 2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-sec-butylphenyl)propanamide CAS Name: N-(2-butan-2-ylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]propanamide IUPAC Name: N-(2-butan-2-ylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: 2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]-N-(2-sec-butylphenyl)propionamide Formula: C21H23N3OS3 MolecularWeight: 429.62182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NN(C(=S)S2)C3=CC=CC=C3

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NN(C(=S)S2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS3/c1-4-14(2)17-12-8-9-13-18(17)22-19(25)15(3)27-20-23-24(21(26)28-20)16-10-6-5-7-11-16/h5-15H,4H2,1-3H3,(H,22,25)