7-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-3-(2-methyl-1,3-thiazol-4-yl)chromen-2-one

Systemtic Name: 7-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-3-(2-methyl-1,3-thiazol-4-yl)chromen-2-one Openeye Name: 7-[2-(azepan-1-yl)-2-oxo-ethoxy]-3-(2-methylthiazol-4-yl)chromen-2-one CAS Name: 7-[2-(1-azepanyl)-2-oxoethoxy]-3-(2-methyl-4-thiazolyl)-1-benzopyran-2-one IUPAC Name: 7-[2-(azepan-1-yl)-2-oxoethoxy]-3-(2-methyl-1,3-thiazol-4-yl)chromen-2-one Traditional Name: 7-[2-(azepan-1-yl)-2-keto-ethoxy]-3-(2-methylthiazol-4-yl)coumarin Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC3=C(C=C(C=C3)OCC(=O)N4CCCCCC4)OC2=O

Isomeric SMILES

CC1=NC(=CS1)C2=CC3=C(C=C(C=C3)OCC(=O)N4CCCCCC4)OC2=O

InChI

InChI=1S/C21H22N2O4S/c1-14-22-18(13-28-14)17-10-15-6-7-16(11-19(15)27-21(17)25)26-12-20(24)23-8-4-2-3-5-9-23/h6-7,10-11,13H,2-5,8-9,12H2,1H3