N-[5-[2-[4-azanyl-2-(cyclohexylmethylcarbamoylamino)-1,3-thiazol-5-yl]-1,3-thiazol-4-yl]-2,4-bis(fluoranyl)phenyl]-3-methoxy-benzamide

Systemtic Name: N-[5-[2-[4-azanyl-2-(cyclohexylmethylcarbamoylamino)-1,3-thiazol-5-yl]-1,3-thiazol-4-yl]-2,4-bis(fluoranyl)phenyl]-3-methoxy-benzamide Openeye Name: N-[5-[2-[4-amino-2-(cyclohexylmethylcarbamoylamino)thiazol-5-yl]thiazol-4-yl]-2,4-difluoro-phenyl]-3-methoxy-benzamide CAS Name: N-[5-[2-[4-amino-2-[[(cyclohexylmethylamino)-oxomethyl]amino]-5-thiazolyl]-4-thiazolyl]-2,4-difluorophenyl]-3-methoxybenzamide IUPAC Name: N-[5-[2-[4-amino-2-(cyclohexylmethylcarbamoylamino)-1,3-thiazol-5-yl]-1,3-thiazol-4-yl]-2,4-difluorophenyl]-3-methoxybenzamide Traditional Name: N-[5-[2-[4-amino-2-(cyclohexylmethylcarbamoylamino)thiazol-5-yl]thiazol-4-yl]-2,4-difluoro-phenyl]-3-methoxy-benzamide Formula: C28H28F2N6O3S2 MolecularWeight: 598.687126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=C(C=C(C(=C2)C3=CSC(=N3)C4=C(N=C(S4)NC(=O)NCC5CCCCC5)N)F)F

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=C(C=C(C(=C2)C3=CSC(=N3)C4=C(N=C(S4)NC(=O)NCC5CCCCC5)N)F)F

InChI

InChI=1S/C28H28F2N6O3S2/c1-39-17-9-5-8-16(10-17)25(37)33-21-11-18(19(29)12-20(21)30)22-14-40-26(34-22)23-24(31)35-28(41-23)36-27(38)32-13-15-6-3-2-4-7-15/h5,8-12,14-15H,2-4,6-7,13,31H2,1H3,(H,33,37)(H2,32,35,36,38)