1-cycloheptyl-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione

Systemtic Name: 1-cycloheptyl-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione Openeye Name: 1-cycloheptyl-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione CAS Name: 1-cycloheptyl-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione IUPAC Name: 1-cycloheptyl-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione Traditional Name: 1-cycloheptyl-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-quinone Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2C3=C(C(SCC(=O)N3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

C1CCCC(CC1)N2C3=C(C(SCC(=O)N3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C19H23N3O2S/c23-15-12-25-17(13-8-4-3-5-9-13)16-18(20-15)22(21-19(16)24)14-10-6-1-2-7-11-14/h3-5,8-9,14,17H,1-2,6-7,10-12H2,(H,20,23)(H,21,24)