4-azanyl-N5-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]-N5-phenethyl-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]-N5-phenethyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl]-N5-phenethyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]-N5-phenethylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]-5-N-phenethyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-2-keto-1-methyl-2-(p-anisylamino)ethyl]-N'-phenethyl-isothiazole-3,5-dicarboxamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)OC)N(CCC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)OC)N(CCC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C24H27N5O4S/c1-15(23(31)27-14-17-8-10-18(33-2)11-9-17)29(13-12-16-6-4-3-5-7-16)24(32)21-19(25)20(22(26)30)28-34-21/h3-11,15H,12-14,25H2,1-2H3,(H2,26,30)(H,27,31)/t15-/m0/s1