N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(propan-2-ylcarbamoylamino)benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(propan-2-ylcarbamoylamino)benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(isopropylcarbamoylamino)benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-[[oxo-(propan-2-ylamino)methyl]amino]benzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(propan-2-ylcarbamoylamino)benzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(isopropylcarbamoylamino)benzamide Formula: C22H27N5O2S MolecularWeight: 425.54708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C22H27N5O2S/c1-14(2)23-22(29)24-16-8-6-7-15(13-16)21(28)27-19(11-12-30-3)20-25-17-9-4-5-10-18(17)26-20/h4-10,13-14,19H,11-12H2,1-3H3,(H,25,26)(H,27,28)(H2,23,24,29)