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

Systemtic Name: 6-methyl-N-[1-[[(2S)-1-phenyl-5-(4-propan-2-ylsulfonylpiperazin-1-yl)pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[(1S)-1-benzyl-4-(4-isopropylsulfonylpiperazin-1-yl)butyl]carbamoyl]cyclopentyl]-6-methyl-benzothiophene-2-carboxamide CAS Name: 6-methyl-N-[1-[oxo-[[(2S)-1-phenyl-5-(4-propan-2-ylsulfonyl-1-piperazinyl)pentan-2-yl]amino]methyl]cyclopentyl]-1-benzothiophene-2-carboxamide IUPAC Name: 6-methyl-N-[1-[[(2S)-1-phenyl-5-(4-propan-2-ylsulfonylpiperazin-1-yl)pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[(1S)-1-benzyl-4-(4-isopropylsulfonylpiperazino)butyl]carbamoyl]cyclopentyl]-6-methyl-benzothiophene-2-carboxamide Formula: C34H46N4O4S2 MolecularWeight: 638.88344

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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)S(=O)(=O)C(C)C)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(S2)C(=O)NC3(CCCC3)C(=O)N[C@@H](CCCN4CCN(CC4)S(=O)(=O)C(C)C)CC5=CC=CC=C5

InChI

InChI=1S/C34H46N4O4S2/c1-25(2)44(41,42)38-20-18-37(19-21-38)17-9-12-29(23-27-10-5-4-6-11-27)35-33(40)34(15-7-8-16-34)36-32(39)31-24-28-14-13-26(3)22-30(28)43-31/h4-6,10-11,13-14,22,24-25,29H,7-9,12,15-21,23H2,1-3H3,(H,35,40)(H,36,39)/t29-/m0/s1