(2S)-N-(4-azanylbutyl)-2-[4-tert-butyl-2-(3-methylphenyl)imino-1,3-thiazol-3-yl]-4-methyl-pentanamide

Systemtic Name: (2S)-N-(4-azanylbutyl)-2-[4-tert-butyl-2-(3-methylphenyl)imino-1,3-thiazol-3-yl]-4-methyl-pentanamide Openeye Name: (2S)-N-(4-aminobutyl)-2-[4-tert-butyl-2-(m-tolylimino)thiazol-3-yl]-4-methyl-pentanamide CAS Name: (2S)-N-(4-aminobutyl)-2-[4-tert-butyl-2-(3-methylphenyl)imino-3-thiazolyl]-4-methylpentanamide IUPAC Name: (2S)-N-(4-aminobutyl)-2-[4-tert-butyl-2-(3-methylphenyl)imino-1,3-thiazol-3-yl]-4-methylpentanamide Traditional Name: (2S)-N-(4-aminobutyl)-2-[4-tert-butyl-2-(m-tolylimino)-4-thiazolin-3-yl]-4-methyl-valeramide Formula: C24H38N4OS MolecularWeight: 430.64972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N=C2N(C(=CS2)C(C)(C)C)C(CC(C)C)C(=O)NCCCCN

Isomeric SMILES

CC1=CC(=CC=C1)N=C2N(C(=CS2)C(C)(C)C)[C@@H](CC(C)C)C(=O)NCCCCN

InChI

InChI=1S/C24H38N4OS/c1-17(2)14-20(22(29)26-13-8-7-12-25)28-21(24(4,5)6)16-30-23(28)27-19-11-9-10-18(3)15-19/h9-11,15-17,20H,7-8,12-14,25H2,1-6H3,(H,26,29)/t20-/m0/s1