3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C18H17N3O3S/c22-15(20-8-5-12-3-1-2-4-13(12)11-20)6-9-21-17(23)16-14(7-10-25-16)19-18(21)24/h1-4,7,10H,5-6,8-9,11H2,(H,19,24)