1-(4-tert-butylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(4-tert-butylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 1-(4-tert-butylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-(4-tert-butylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(4-tert-butylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 1-(4-tert-butylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C18H23N3OS2 MolecularWeight: 361.52472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(S2)NC3CC3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(S2)NC3CC3

InChI

InChI=1S/C18H23N3OS2/c1-11(23-17-21-20-16(24-17)19-14-9-10-14)15(22)12-5-7-13(8-6-12)18(2,3)4/h5-8,11,14H,9-10H2,1-4H3,(H,19,20)