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

Systemtic Name: 4-azanyl-N5-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-butan-2-yl]-N5-phenethyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-1-[(4-fluorophenyl)methylcarbamoyl]propyl]-N5-phenethyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxobutan-2-yl]-N5-phenethylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxobutan-2-yl]-5-N-phenethyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-1-[(4-fluorobenzyl)carbamoyl]propyl]-N'-phenethyl-isothiazole-3,5-dicarboxamide Formula: C24H26FN5O3S MolecularWeight: 483.558343

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C24H26FN5O3S/c1-2-18(23(32)28-14-16-8-10-17(25)11-9-16)30(13-12-15-6-4-3-5-7-15)24(33)21-19(26)20(22(27)31)29-34-21/h3-11,18H,2,12-14,26H2,1H3,(H2,27,31)(H,28,32)/t18-/m0/s1