7-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)-4-ethyl-1H-quinoxaline-2,3-dione

Systemtic Name: 7-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)-4-ethyl-1H-quinoxaline-2,3-dione Openeye Name: 7-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-4-ethyl-1H-quinoxaline-2,3-dione CAS Name: 7-[3,4-dihydro-2H-1,5-benzothiazepin-5-yl(oxo)methyl]-4-ethyl-1H-quinoxaline-2,3-dione IUPAC Name: 7-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-4-ethyl-1H-quinoxaline-2,3-dione Traditional Name: 7-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-4-ethyl-1H-quinoxaline-2,3-quinone Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCCSC4=CC=CC=C43)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCCSC4=CC=CC=C43)NC(=O)C1=O

InChI

InChI=1S/C20H19N3O3S/c1-2-22-15-9-8-13(12-14(15)21-18(24)20(22)26)19(25)23-10-5-11-27-17-7-4-3-6-16(17)23/h3-4,6-9,12H,2,5,10-11H2,1H3,(H,21,24)