tert-butyl N-(1-benzothiophen-3-yl)-N-[2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: tert-butyl N-(1-benzothiophen-3-yl)-N-[2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]carbamate Openeye Name: tert-butyl N-(benzothiophen-3-yl)-N-[2-[4-(1-methyl-4-piperidyl)piperazin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-(1-benzothiophen-3-yl)-N-[2-[4-(1-methyl-4-piperidinyl)-1-piperazinyl]-2-oxoethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-benzothiophen-3-yl)-N-[2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-oxoethyl]carbamate Traditional Name: N-(benzothiophen-3-yl)-N-[2-keto-2-[4-(1-methyl-4-piperidyl)piperazino]ethyl]carbamic acid tert-butyl ester Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)N1CCN(CC1)C2CCN(CC2)C)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)N1CCN(CC1)C2CCN(CC2)C)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C25H36N4O3S/c1-25(2,3)32-24(31)29(21-18-33-22-8-6-5-7-20(21)22)17-23(30)28-15-13-27(14-16-28)19-9-11-26(4)12-10-19/h5-8,18-19H,9-17H2,1-4H3