(5-methyl-1-benzothiophen-2-yl) N-[1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylcarbamoyl-phenethyl-carbamoyl]cyclopentyl]carbamate

Systemtic Name: (5-methyl-1-benzothiophen-2-yl) N-[1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylcarbamoyl-phenethyl-carbamoyl]cyclopentyl]carbamate Openeye Name: (5-methylbenzothiophen-2-yl) N-[1-[phenethyl-[[1-(tetrahydropyran-4-ylmethyl)-4-piperidyl]methylcarbamoyl]carbamoyl]cyclopentyl]carbamate CAS Name: N-[1-[[[[[1-(4-oxanylmethyl)-4-piperidinyl]methylamino]-oxomethyl]-phenethylamino]-oxomethyl]cyclopentyl]carbamic acid (5-methyl-1-benzothiophen-2-yl) ester IUPAC Name: (5-methyl-1-benzothiophen-2-yl) N-[1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylcarbamoyl-phenethylcarbamoyl]cyclopentyl]carbamate Traditional Name: N-[1-[phenethyl-[[1-(tetrahydropyran-4-ylmethyl)-4-piperidyl]methylcarbamoyl]carbamoyl]cyclopentyl]carbamic acid (5-methylbenzothiophen-2-yl) ester Formula: C37H48N4O5S MolecularWeight: 660.86582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=C2)OC(=O)NC3(CCCC3)C(=O)N(CCC4=CC=CC=C4)C(=O)NCC5CCN(CC5)CC6CCOCC6

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=C2)OC(=O)NC3(CCCC3)C(=O)N(CCC4=CC=CC=C4)C(=O)NCC5CCN(CC5)CC6CCOCC6

InChI

InChI=1S/C37H48N4O5S/c1-27-9-10-32-31(23-27)24-33(47-32)46-36(44)39-37(16-5-6-17-37)34(42)41(20-13-28-7-3-2-4-8-28)35(43)38-25-29-11-18-40(19-12-29)26-30-14-21-45-22-15-30/h2-4,7-10,23-24,29-30H,5-6,11-22,25-26H2,1H3,(H,38,43)(H,39,44)