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

Systemtic Name: 4-azanyl-N5-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-butan-2-yl]-N5-phenyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-1-[(4-methoxyphenyl)methylcarbamoyl]propyl]-N5-phenyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxobutan-2-yl]-N5-phenylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxobutan-2-yl]-5-N-phenyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-1-(p-anisylcarbamoyl)propyl]-N'-phenyl-isothiazole-3,5-dicarboxamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N5O4S/c1-3-17(22(30)26-13-14-9-11-16(32-2)12-10-14)28(15-7-5-4-6-8-15)23(31)20-18(24)19(21(25)29)27-33-20/h4-12,17H,3,13,24H2,1-2H3,(H2,25,29)(H,26,30)/t17-/m0/s1