(3S)-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-butanamide

Systemtic Name: (3S)-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-butanamide Openeye Name: (3S)-3-phenyl-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: (3S)-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-3-phenylbutanamide IUPAC Name: (3S)-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylbutanamide Traditional Name: (3S)-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-3-phenyl-butyramide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3OS2/c1-14-8-10-16(11-9-14)13-25-20-23-22-19(26-20)21-18(24)12-15(2)17-6-4-3-5-7-17/h3-11,15H,12-13H2,1-2H3,(H,21,22,24)/t15-/m0/s1