1-[5,5-bis(oxidanylidene)-6-propyl-benzo[c][1,2,5]benzothiadiazepin-11-yl]-2-(dimethylamino)ethanone

Systemtic Name: 1-[5,5-bis(oxidanylidene)-6-propyl-benzo[c][1,2,5]benzothiadiazepin-11-yl]-2-(dimethylamino)ethanone Openeye Name: 2-(dimethylamino)-1-(5,5-dioxo-6-propyl-benzo[c][1,2,5]benzothiadiazepin-11-yl)ethanone CAS Name: 2-(dimethylamino)-1-(5,5-dioxo-6-propyl-11-benzo[c][1,2,5]benzothiadiazepinyl)ethanone IUPAC Name: 2-(dimethylamino)-1-(5,5-dioxo-6-propylbenzo[c][1,2,5]benzothiadiazepin-11-yl)ethanone Traditional Name: 1-(5,5-diketo-6-propyl-benzo[c][1,2,5]benzothiadiazepin-11-yl)-2-(dimethylamino)ethanone Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C3=CC=CC=C3S1(=O)=O)C(=O)CN(C)C

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C3=CC=CC=C3S1(=O)=O)C(=O)CN(C)C

InChI

InChI=1S/C19H23N3O3S/c1-4-13-21-15-9-5-6-10-16(15)22(19(23)14-20(2)3)17-11-7-8-12-18(17)26(21,24)25/h5-12H,4,13-14H2,1-3H3