4-azanyl-N5-[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-hexan-2-yl]-N5-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-hexan-2-yl]-N5-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-1-(isopentylcarbamoyl)pentyl]-N5-(4-isopropylphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2S)-1-(3-methylbutylamino)-1-oxohexan-2-yl]-N5-(4-propan-2-ylphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2S)-1-(3-methylbutylamino)-1-oxohexan-2-yl]-5-N-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-1-(isoamylcarbamoyl)pentyl]-N'-p-cumenyl-isothiazole-3,5-dicarboxamide Formula: C25H37N5O3S MolecularWeight: 487.65798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37N5O3S/c1-6-7-8-19(24(32)28-14-13-15(2)3)30(18-11-9-17(10-12-18)16(4)5)25(33)22-20(26)21(23(27)31)29-34-22/h9-12,15-16,19H,6-8,13-14,26H2,1-5H3,(H2,27,31)(H,28,32)/t19-/m0/s1