(2S)-2-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: (2S)-2-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-N-(4-propan-2-ylphenyl)propanamide Openeye Name: (2S)-2-[2-(2-amino-2-oxo-ethyl)sulfanylanilino]-N-(4-isopropylphenyl)propanamide CAS Name: (2S)-2-[2-[(2-amino-2-oxoethyl)thio]anilino]-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: (2S)-2-[2-(2-amino-2-oxoethyl)sulfanylanilino]-N-(4-propan-2-ylphenyl)propanamide Traditional Name: (2S)-2-[2-[(2-amino-2-keto-ethyl)thio]anilino]-N-p-cumenyl-propionamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C(C)NC2=CC=CC=C2SCC(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(C)C)NC2=CC=CC=C2SCC(=O)N

InChI

InChI=1S/C20H25N3O2S/c1-13(2)15-8-10-16(11-9-15)23-20(25)14(3)22-17-6-4-5-7-18(17)26-12-19(21)24/h4-11,13-14,22H,12H2,1-3H3,(H2,21,24)(H,23,25)/t14-/m0/s1