(2S)-1-(4-methylphenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(4-methylphenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: (2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(p-tolyl)propan-1-one CAS Name: (2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-(4-methylphenyl)-1-propanone IUPAC Name: (2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-methylphenyl)propan-1-one Traditional Name: (2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-(p-tolyl)propan-1-one Formula: C18H17N3OS2 MolecularWeight: 355.47708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS2/c1-12-8-10-14(11-9-12)16(22)13(2)23-18-21-20-17(24-18)19-15-6-4-3-5-7-15/h3-11,13H,1-2H3,(H,19,20)/t13-/m0/s1