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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=CC=CC=C5S4

InChI

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