3-[2-chloranyl-5-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[2-chloranyl-5-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[2-chloro-5-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione CAS Name: 3-[2-chloro-5-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[2-chloro-5-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylsulfonyl)phenyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[2-chloro-5-(3,5-dihydro-2H-4,1-benzothiazepin-1-ylsulfonyl)phenyl]-1H-quinazoline-2,4-quinone Formula: C23H18ClN3O4S2 MolecularWeight: 499.98972

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC2=CC=CC=C2N1S(=O)(=O)C3=CC(=C(C=C3)Cl)N4C(=O)C5=CC=CC=C5NC4=O

Isomeric SMILES

C1CSCC2=CC=CC=C2N1S(=O)(=O)C3=CC(=C(C=C3)Cl)N4C(=O)C5=CC=CC=C5NC4=O

InChI

InChI=1S/C23H18ClN3O4S2/c24-18-10-9-16(33(30,31)26-11-12-32-14-15-5-1-4-8-20(15)26)13-21(18)27-22(28)17-6-2-3-7-19(17)25-23(27)29/h1-10,13H,11-12,14H2,(H,25,29)