2-azanyl-N-[1-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-2-methyl-propanamide

Systemtic Name: 2-azanyl-N-[1-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-2-methyl-propanamide Openeye Name: 2-amino-N-[2-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-2-methyl-propanamide CAS Name: 2-amino-N-[1-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide IUPAC Name: 2-amino-N-[1-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide Traditional Name: 2-amino-N-[2-[4-(5-chloro-2-keto-3H-benzimidazol-1-yl)piperidino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-2-methyl-propionamide Formula: C27H31ClN6O3 MolecularWeight: 523.02644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCC(CC3)N4C5=C(C=C(C=C5)Cl)NC4=O)N

Isomeric SMILES

CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCC(CC3)N4C5=C(C=C(C=C5)Cl)NC4=O)N

InChI

InChI=1S/C27H31ClN6O3/c1-27(2,29)25(36)31-22(13-16-15-30-20-6-4-3-5-19(16)20)24(35)33-11-9-18(10-12-33)34-23-8-7-17(28)14-21(23)32-26(34)37/h3-8,14-15,18,22,30H,9-13,29H2,1-2H3,(H,31,36)(H,32,37)