[(2R)-1-oxidanylidene-1-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pentan-2-yl] N-(5-chloranylthiophen-2-yl)carbamate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pentan-2-yl] N-(5-chloranylthiophen-2-yl)carbamate Openeye Name: [(1R)-1-[[1-(4-pyridyl)-4-piperidyl]methylcarbamoyl]butyl] N-(5-chloro-2-thienyl)carbamate CAS Name: N-(5-chloro-2-thiophenyl)carbamic acid [(2R)-1-oxo-1-[(1-pyridin-4-yl-4-piperidinyl)methylamino]pentan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pentan-2-yl] N-(5-chlorothiophen-2-yl)carbamate Traditional Name: N-(5-chloro-2-thienyl)carbamic acid [(1R)-1-[[1-(4-pyridyl)-4-piperidyl]methylcarbamoyl]butyl] ester Formula: C21H27ClN4O3S MolecularWeight: 450.98208

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCC1CCN(CC1)C2=CC=NC=C2)OC(=O)NC3=CC=C(S3)Cl

Isomeric SMILES

CCC[C@H](C(=O)NCC1CCN(CC1)C2=CC=NC=C2)OC(=O)NC3=CC=C(S3)Cl

InChI

InChI=1S/C21H27ClN4O3S/c1-2-3-17(29-21(28)25-19-5-4-18(22)30-19)20(27)24-14-15-8-12-26(13-9-15)16-6-10-23-11-7-16/h4-7,10-11,15,17H,2-3,8-9,12-14H2,1H3,(H,24,27)(H,25,28)/t17-/m1/s1