4-azanyl-N3-cyclohexyl-N5-[1-(4-fluorophenyl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N5-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N3-cyclohexyl-N5-[1-(4-fluorophenyl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N5-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(benzylamino)-1-(4-fluorophenyl)-2-oxo-ethyl]-N3-cyclohexyl-N5-(4-isopropylphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N3-cyclohexyl-N5-[1-(4-fluorophenyl)-2-oxo-2-[(phenylmethyl)amino]ethyl]-N5-(4-propan-2-ylphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(benzylamino)-1-(4-fluorophenyl)-2-oxoethyl]-3-N-cyclohexyl-5-N-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(benzylamino)-1-(4-fluorophenyl)-2-keto-ethyl]-N-cyclohexyl-N'-p-cumenyl-isothiazole-3,5-dicarboxamide Formula: C35H38FN5O3S MolecularWeight: 627.771323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(C(C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3)C(=O)C4=C(C(=NS4)C(=O)NC5CCCCC5)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(C(C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3)C(=O)C4=C(C(=NS4)C(=O)NC5CCCCC5)N

InChI

InChI=1S/C35H38FN5O3S/c1-22(2)24-15-19-28(20-16-24)41(35(44)32-29(37)30(40-45-32)33(42)39-27-11-7-4-8-12-27)31(25-13-17-26(36)18-14-25)34(43)38-21-23-9-5-3-6-10-23/h3,5-6,9-10,13-20,22,27,31H,4,7-8,11-12,21,37H2,1-2H3,(H,38,43)(H,39,42)