4-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-7-ethyl-chromen-2-one

Systemtic Name: 4-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-7-ethyl-chromen-2-one Openeye Name: 4-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-7-ethyl-chromen-2-one CAS Name: 4-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-7-ethylchromen-2-one Traditional Name: 4-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-7-ethyl-coumarin Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CN(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CN(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2O2S/c1-3-14-8-9-16-15(11-21(24)25-18(16)10-14)12-23(2)13-20-22-17-6-4-5-7-19(17)26-20/h4-11H,3,12-13H2,1-2H3