3-[4-oxidanylidene-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[4-oxidanylidene-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[4-keto-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C21H21N3O3S/c25-18(23-12-8-16(9-13-23)15-5-2-1-3-6-15)7-4-11-24-20(26)19-17(10-14-28-19)22-21(24)27/h1-3,5-6,8,10,14H,4,7,9,11-13H2,(H,22,27)