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

Systemtic Name: 2-azanyl-N-[3-(1-benzothiophen-3-yl)-1-oxidanylidene-1-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-2-methyl-propanamide Openeye Name: 2-amino-N-[1-(benzothiophen-3-ylmethyl)-2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]ethyl]-2-methyl-propanamide CAS Name: 2-amino-N-[3-(1-benzothiophen-3-yl)-1-oxo-1-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]propan-2-yl]-2-methylpropanamide IUPAC Name: 2-amino-N-[3-(1-benzothiophen-3-yl)-1-oxo-1-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-2-methylpropanamide Traditional Name: 2-amino-N-[1-(benzothiophen-3-ylmethyl)-2-keto-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]ethyl]-2-methyl-propionamide Formula: C27H31N5O3S MolecularWeight: 505.63174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC1=CSC2=CC=CC=C21)C(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)N

Isomeric SMILES

CC(C)(C(=O)NC(CC1=CSC2=CC=CC=C21)C(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)N

InChI

InChI=1S/C27H31N5O3S/c1-27(2,28)25(34)29-21(15-17-16-36-23-10-6-3-7-19(17)23)24(33)31-13-11-18(12-14-31)32-22-9-5-4-8-20(22)30-26(32)35/h3-10,16,18,21H,11-15,28H2,1-2H3,(H,29,34)(H,30,35)