N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[[(R)-(4-propylphenyl)-thiophen-2-yl-methyl]amino]ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[[(R)-(4-propylphenyl)-thiophen-2-yl-methyl]amino]ethanamide Openeye Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[[(R)-(4-propylphenyl)-(2-thienyl)methyl]amino]acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[[(R)-(4-propylphenyl)-thiophen-2-ylmethyl]amino]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[[(R)-(4-propylphenyl)-thiophen-2-ylmethyl]amino]acetamide Traditional Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[[(R)-(4-propylphenyl)-(2-thienyl)methyl]amino]acetamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@H](C2=CC=CS2)NCC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C22H29N3OS/c1-5-7-17-9-11-18(12-10-17)21(19-8-6-13-27-19)24-14-20(26)25-22(4,15-23)16(2)3/h6,8-13,16,21,24H,5,7,14H2,1-4H3,(H,25,26)/t21-,22-/m1/s1