4-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one Openeye Name: 4-[[5-(4-isopropylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(2-thienyl)butan-1-one CAS Name: 4-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[(5-cumidino-1,3,4-thiadiazol-2-yl)thio]-1-(2-thienyl)butan-1-one Formula: C19H21N3OS3 MolecularWeight: 403.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCCCC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C19H21N3OS3/c1-13(2)14-7-9-15(10-8-14)20-18-21-22-19(26-18)25-12-3-5-16(23)17-6-4-11-24-17/h4,6-11,13H,3,5,12H2,1-2H3,(H,20,21)