N-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butanamide Openeye Name: N-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butanamide CAS Name: N-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutanamide IUPAC Name: N-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutanamide Traditional Name: N-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyramide Formula: C25H20BrN3O4S MolecularWeight: 538.413

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)NC3=NC(=CS3)C4=CC5=C(C=CC(=C5)Br)OC4=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)NC3=NC(=CS3)C4=CC5=C(C=CC(=C5)Br)OC4=O

InChI

InChI=1S/C25H20BrN3O4S/c26-18-5-6-21-17(11-18)12-19(24(32)33-21)20-14-34-25(27-20)28-22(30)7-8-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-6,11-12,14H,7-10,13H2,(H,27,28,30)