4-phenyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one

Systemtic Name: 4-phenyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one Openeye Name: 4-phenyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one CAS Name: 4-phenyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one IUPAC Name: 4-phenyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one Traditional Name: 4-phenyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N=C2C(=CNN2)C(S1)C3=CC=CC=C3

Isomeric SMILES

C1C(=O)N=C2C(=CNN2)C(S1)C3=CC=CC=C3

InChI

InChI=1S/C12H11N3OS/c16-10-7-17-11(8-4-2-1-3-5-8)9-6-13-15-12(9)14-10/h1-6,11H,7H2,(H2,13,14,15,16)