8-(azepan-1-ylmethyl)-3-(1,3-benzothiazol-2-yl)-2-methyl-7-oxidanyl-chromen-4-one

Systemtic Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzothiazol-2-yl)-2-methyl-7-oxidanyl-chromen-4-one Openeye Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-chromen-4-one CAS Name: 8-(1-azepanylmethyl)-3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-1-benzopyran-4-one IUPAC Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methylchromen-4-one Traditional Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-chromone Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCCCCC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCCCCC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H24N2O3S/c1-15-21(24-25-18-8-4-5-9-20(18)30-24)22(28)16-10-11-19(27)17(23(16)29-15)14-26-12-6-2-3-7-13-26/h4-5,8-11,27H,2-3,6-7,12-14H2,1H3