4-[[1-(1-benzothiophen-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-chromen-2-one

Systemtic Name: 4-[[1-(1-benzothiophen-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-chromen-2-one Openeye Name: 4-[[1-(benzothiophen-5-ylmethyl)-4-piperidyl]amino]-6-chloro-chromen-2-one CAS Name: 4-[[1-(1-benzothiophen-5-ylmethyl)-4-piperidinyl]amino]-6-chloro-1-benzopyran-2-one IUPAC Name: 4-[[1-(1-benzothiophen-5-ylmethyl)piperidin-4-yl]amino]-6-chlorochromen-2-one Traditional Name: 4-[[1-(benzothiophen-5-ylmethyl)-4-piperidyl]amino]-6-chloro-coumarin Formula: C23H21ClN2O2S MolecularWeight: 424.94304

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=C(C=C4)SC=C5

Isomeric SMILES

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=C(C=C4)SC=C5

InChI

InChI=1S/C23H21ClN2O2S/c24-17-2-3-21-19(12-17)20(13-23(27)28-21)25-18-5-8-26(9-6-18)14-15-1-4-22-16(11-15)7-10-29-22/h1-4,7,10-13,18,25H,5-6,8-9,14H2