N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-[(2-fluorophenyl)carbonylamino]-4-methyl-benzamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-[(2-fluorophenyl)carbonylamino]-4-methyl-benzamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-[(2-fluorobenzoyl)amino]-4-methyl-benzamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-[[(2-fluorophenyl)-oxomethyl]amino]-4-methylbenzamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-[(2-fluorobenzoyl)amino]-4-methylbenzamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-[(2-fluorobenzoyl)amino]-4-methyl-benzamide Formula: C26H25FN4O2S MolecularWeight: 476.565703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C26H25FN4O2S/c1-16-11-12-17(15-23(16)31-26(33)18-7-3-4-8-19(18)27)25(32)30-22(13-14-34-2)24-28-20-9-5-6-10-21(20)29-24/h3-12,15,22H,13-14H2,1-2H3,(H,28,29)(H,30,32)(H,31,33)/t22-/m0/s1