(2S)-N-cyclohexyl-N-ethyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: (2S)-2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide CAS Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: (2S)-2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-cyclohexyl-N-ethylpropanamide Traditional Name: (2S)-2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]-N-cyclohexyl-N-ethyl-propionamide Formula: C20H28N4OS2 MolecularWeight: 404.59252

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=C(S2)NCC3=CC=CC=C3

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NN=C(S2)NCC3=CC=CC=C3

InChI

InChI=1S/C20H28N4OS2/c1-3-24(17-12-8-5-9-13-17)18(25)15(2)26-20-23-22-19(27-20)21-14-16-10-6-4-7-11-16/h4,6-7,10-11,15,17H,3,5,8-9,12-14H2,1-2H3,(H,21,22)/t15-/m0/s1