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

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]butanamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-[4-(2-oxochromen-3-yl)thiazol-2-yl]butanamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]butanamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-N-[4-(2-ketochromen-3-yl)thiazol-2-yl]butyramide Formula: C25H21N3O4S MolecularWeight: 459.51694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)NC3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)NC3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H21N3O4S/c29-22(9-10-23(30)28-12-11-16-5-1-2-7-18(16)14-28)27-25-26-20(15-33-25)19-13-17-6-3-4-8-21(17)32-24(19)31/h1-8,13,15H,9-12,14H2,(H,26,27,29)