4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-1-(thiophen-2-ylmethyl)quinolin-2-one

Systemtic Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-1-(thiophen-2-ylmethyl)quinolin-2-one Openeye Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]amino]-6-chloro-1-(2-thienylmethyl)quinolin-2-one CAS Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]amino]-6-chloro-1-(thiophen-2-ylmethyl)-2-quinolinone IUPAC Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloro-1-(thiophen-2-ylmethyl)quinolin-2-one Traditional Name: 6-chloro-4-[(1-piperonyl-4-piperidyl)amino]-1-(2-thenyl)carbostyril Formula: C27H26ClN3O3S MolecularWeight: 508.03164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC(=O)N(C3=C2C=C(C=C3)Cl)CC4=CC=CS4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCC1NC2=CC(=O)N(C3=C2C=C(C=C3)Cl)CC4=CC=CS4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H26ClN3O3S/c28-19-4-5-24-22(13-19)23(14-27(32)31(24)16-21-2-1-11-35-21)29-20-7-9-30(10-8-20)15-18-3-6-25-26(12-18)34-17-33-25/h1-6,11-14,20,29H,7-10,15-17H2