N'-[(2S)-3-cyclohexyl-1-(3-phenylpropylamino)-1-sulfanylidene-propan-2-yl]butanediamide

Systemtic Name: N'-[(2S)-3-cyclohexyl-1-(3-phenylpropylamino)-1-sulfanylidene-propan-2-yl]butanediamide Openeye Name: N'-[(1S)-1-(cyclohexylmethyl)-2-(3-phenylpropylamino)-2-thioxo-ethyl]butanediamide CAS Name: N'-[(2S)-3-cyclohexyl-1-(3-phenylpropylamino)-1-sulfanylidenepropan-2-yl]butanediamide IUPAC Name: N'-[(2S)-3-cyclohexyl-1-(3-phenylpropylamino)-1-sulfanylidenepropan-2-yl]butanediamide Traditional Name: N'-[(1S)-1-(cyclohexylmethyl)-2-(3-phenylpropylamino)-2-thioxo-ethyl]succinamide Formula: C22H33N3O2S MolecularWeight: 403.58132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=S)NCCCC2=CC=CC=C2)NC(=O)CCC(=O)N

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=S)NCCCC2=CC=CC=C2)NC(=O)CCC(=O)N

InChI

InChI=1S/C22H33N3O2S/c23-20(26)13-14-21(27)25-19(16-18-10-5-2-6-11-18)22(28)24-15-7-12-17-8-3-1-4-9-17/h1,3-4,8-9,18-19H,2,5-7,10-16H2,(H2,23,26)(H,24,28)(H,25,27)/t19-/m0/s1