N-[(2S)-1-[[(1R)-1-cyano-2-phenylmethoxy-ethyl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[[(1R)-1-cyano-2-phenylmethoxy-ethyl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-2-[[(1R)-2-benzyloxy-1-cyano-ethyl]amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-[[(1R)-1-cyano-2-phenylmethoxyethyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-[[(1R)-1-cyano-2-phenylmethoxyethyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-2-[[(1R)-2-benzoxy-1-cyano-ethyl]amino]-1-(cyclohexylmethyl)-2-keto-ethyl]thiophene-2-carboxamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC(COCC2=CC=CC=C2)C#N)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)N[C@@H](COCC2=CC=CC=C2)C#N)NC(=O)C3=CC=CS3

InChI

InChI=1S/C24H29N3O3S/c25-15-20(17-30-16-19-10-5-2-6-11-19)26-23(28)21(14-18-8-3-1-4-9-18)27-24(29)22-12-7-13-31-22/h2,5-7,10-13,18,20-21H,1,3-4,8-9,14,16-17H2,(H,26,28)(H,27,29)/t20-,21+/m1/s1