4-azanyl-N5-[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxidanylidene-pentan-2-yl]-N5-(3-methylphenyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxidanylidene-pentan-2-yl]-N5-(3-methylphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-1-(isopentylcarbamoyl)-3-methyl-butyl]-N5-(m-tolyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]-N5-(3-methylphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]-5-N-(3-methylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-1-(isoamylcarbamoyl)-3-methyl-butyl]-N'-(m-tolyl)isothiazole-3,5-dicarboxamide Formula: C23H33N5O3S MolecularWeight: 459.60482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C(CC(C)C)C(=O)NCCC(C)C)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CC1=CC(=CC=C1)N([C@@H](CC(C)C)C(=O)NCCC(C)C)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C23H33N5O3S/c1-13(2)9-10-26-22(30)17(11-14(3)4)28(16-8-6-7-15(5)12-16)23(31)20-18(24)19(21(25)29)27-32-20/h6-8,12-14,17H,9-11,24H2,1-5H3,(H2,25,29)(H,26,30)/t17-/m0/s1