4-(2-azanyl-1,3-thiazol-4-yl)-N-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]-(pyridin-2-ylmethyl)amino]ethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 4-(2-azanyl-1,3-thiazol-4-yl)-N-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]-(pyridin-2-ylmethyl)amino]ethyl]-N-(phenylmethyl)benzamide Openeye Name: 4-(2-aminothiazol-4-yl)-N-benzyl-N-[2-oxo-2-[[(1S)-1-phenylethyl]-(2-pyridylmethyl)amino]ethyl]benzamide CAS Name: 4-(2-amino-4-thiazolyl)-N-[2-oxo-2-[[(1S)-1-phenylethyl]-(2-pyridinylmethyl)amino]ethyl]-N-(phenylmethyl)benzamide IUPAC Name: 4-(2-amino-1,3-thiazol-4-yl)-N-benzyl-N-[2-oxo-2-[[(1S)-1-phenylethyl]-(pyridin-2-ylmethyl)amino]ethyl]benzamide Traditional Name: 4-(2-aminothiazol-4-yl)-N-benzyl-N-[2-keto-2-[[(1S)-1-phenylethyl]-(2-pyridylmethyl)amino]ethyl]benzamide Formula: C33H31N5O2S MolecularWeight: 561.69654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=N2)C(=O)CN(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C5=CSC(=N5)N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CC2=CC=CC=N2)C(=O)CN(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C5=CSC(=N5)N

InChI

InChI=1S/C33H31N5O2S/c1-24(26-12-6-3-7-13-26)38(21-29-14-8-9-19-35-29)31(39)22-37(20-25-10-4-2-5-11-25)32(40)28-17-15-27(16-18-28)30-23-41-33(34)36-30/h2-19,23-24H,20-22H2,1H3,(H2,34,36)/t24-/m0/s1