3-[2-chloranyl-5-(5,6,7,8-tetrahydrothieno[3,2-b]azepin-4-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[2-chloranyl-5-(5,6,7,8-tetrahydrothieno[3,2-b]azepin-4-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[2-chloro-5-(5,6,7,8-tetrahydrothieno[3,2-b]azepin-4-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione CAS Name: 3-[2-chloro-5-(5,6,7,8-tetrahydrothieno[3,2-b]azepin-4-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[2-chloro-5-(5,6,7,8-tetrahydrothieno[3,2-b]azepin-4-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[2-chloro-5-(5,6,7,8-tetrahydrothien[3,2-b]azepin-4-ylsulfonyl)phenyl]-1H-quinazoline-2,4-quinone Formula: C22H18ClN3O4S2 MolecularWeight: 487.97902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=C(C1)SC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)N4C(=O)C5=CC=CC=C5NC4=O

Isomeric SMILES

C1CCN(C2=C(C1)SC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)N4C(=O)C5=CC=CC=C5NC4=O

InChI

InChI=1S/C22H18ClN3O4S2/c23-16-9-8-14(32(29,30)25-11-4-3-7-20-18(25)10-12-31-20)13-19(16)26-21(27)15-5-1-2-6-17(15)24-22(26)28/h1-2,5-6,8-10,12-13H,3-4,7,11H2,(H,24,28)