2-cyclohexyl-5-methyl-4,4-bis(oxidanylidene)pyrazolo[3,4-c][2,1]benzothiazepin-10-one

Systemtic Name: 2-cyclohexyl-5-methyl-4,4-bis(oxidanylidene)pyrazolo[3,4-c][2,1]benzothiazepin-10-one Openeye Name: 2-cyclohexyl-5-methyl-4,4-dioxo-pyrazolo[3,4-c][2,1]benzothiazepin-10-one CAS Name: 2-cyclohexyl-5-methyl-4,4-dioxo-10-pyrazolo[3,4-c][2,1]benzothiazepinone IUPAC Name: 2-cyclohexyl-5-methyl-4,4-dioxopyrazolo[3,4-c][2,1]benzothiazepin-10-one Traditional Name: 2-cyclohexyl-4,4-diketo-5-methyl-pyrazolo[3,4-c][2,1]benzothiazepin-10-one Formula: C17H19N3O3S MolecularWeight: 345.41606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C3=CN(N=C3S1(=O)=O)C4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C3=CN(N=C3S1(=O)=O)C4CCCCC4

InChI

InChI=1S/C17H19N3O3S/c1-19-15-10-6-5-9-13(15)16(21)14-11-20(12-7-3-2-4-8-12)18-17(14)24(19,22)23/h5-6,9-12H,2-4,7-8H2,1H3