4-[[1-(1-benzothiophen-3-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-chromen-2-one

Systemtic Name: 4-[[1-(1-benzothiophen-3-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-chromen-2-one Openeye Name: 4-[[1-(benzothiophen-3-ylmethyl)-4-piperidyl]amino]-6-chloro-chromen-2-one CAS Name: 4-[[1-(1-benzothiophen-3-ylmethyl)-4-piperidinyl]amino]-6-chloro-1-benzopyran-2-one IUPAC Name: 4-[[1-(1-benzothiophen-3-ylmethyl)piperidin-4-yl]amino]-6-chlorochromen-2-one Traditional Name: 4-[[1-(benzothiophen-3-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=CSC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CSC5=CC=CC=C54

InChI

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