N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C23H29N5O2S MolecularWeight: 439.57366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C23H29N5O2S/c1-15(2)25-23(30)24-14-16-8-10-17(11-9-16)22(29)28-20(12-13-31-3)21-26-18-6-4-5-7-19(18)27-21/h4-11,15,20H,12-14H2,1-3H3,(H,26,27)(H,28,29)(H2,24,25,30)