3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-8-methyl-7-oxidanyl-2-propan-2-yl-chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-8-methyl-7-oxidanyl-2-propan-2-yl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-6-[(diisobutylamino)methyl]-7-hydroxy-2-isopropyl-8-methyl-chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-8-methyl-2-propan-2-yl-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-8-methyl-2-propan-2-ylchromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-[(diisobutylamino)methyl]-7-hydroxy-2-isopropyl-8-methyl-chromone Formula: C29H36N2O3S MolecularWeight: 492.67274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)CN(CC(C)C)CC(C)C)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C2C(=CC(=C1O)CN(CC(C)C)CC(C)C)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C29H36N2O3S/c1-16(2)13-31(14-17(3)4)15-20-12-21-26(33)24(29-30-22-10-8-9-11-23(22)35-29)27(18(5)6)34-28(21)19(7)25(20)32/h8-12,16-18,32H,13-15H2,1-7H3