3-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylchromen-2-one Openeye Name: 3-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]chromen-2-one CAS Name: 3-[[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]chromen-2-one Traditional Name: 3-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]coumarin Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=CC=CC=C3OC2=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC3=CC=CC=C3OC2=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H18N2O3S/c25-21(16-12-14-6-1-3-9-18(14)27-22(16)26)24-11-5-7-15(13-24)20-23-17-8-2-4-10-19(17)28-20/h1-4,6,8-10,12,15H,5,7,11,13H2