6-methyl-N-[1-[[(2S)-1-phenyl-5-(4-pyridin-2-ylpiperazin-1-yl)pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 6-methyl-N-[1-[[(2S)-1-phenyl-5-(4-pyridin-2-ylpiperazin-1-yl)pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[(1S)-1-benzyl-4-[4-(2-pyridyl)piperazin-1-yl]butyl]carbamoyl]cyclopentyl]-6-methyl-benzothiophene-2-carboxamide CAS Name: 6-methyl-N-[1-[oxo-[[(2S)-1-phenyl-5-[4-(2-pyridinyl)-1-piperazinyl]pentan-2-yl]amino]methyl]cyclopentyl]-1-benzothiophene-2-carboxamide IUPAC Name: 6-methyl-N-[1-[[(2S)-1-phenyl-5-(4-pyridin-2-ylpiperazin-1-yl)pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[(1S)-1-benzyl-4-[4-(2-pyridyl)piperazino]butyl]carbamoyl]cyclopentyl]-6-methyl-benzothiophene-2-carboxamide Formula: C36H43N5O2S MolecularWeight: 609.82392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(S2)C(=O)NC3(CCCC3)C(=O)NC(CCCN4CCN(CC4)C5=CC=CC=N5)CC6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(S2)C(=O)NC3(CCCC3)C(=O)N[C@@H](CCCN4CCN(CC4)C5=CC=CC=N5)CC6=CC=CC=C6

InChI

InChI=1S/C36H43N5O2S/c1-27-14-15-29-26-32(44-31(29)24-27)34(42)39-36(16-6-7-17-36)35(43)38-30(25-28-10-3-2-4-11-28)12-9-19-40-20-22-41(23-21-40)33-13-5-8-18-37-33/h2-5,8,10-11,13-15,18,24,26,30H,6-7,9,12,16-17,19-23,25H2,1H3,(H,38,43)(H,39,42)/t30-/m0/s1