1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-phenyl-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-phenyl-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-phenyl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-N-phenyl-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-phenyl-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-N-phenyl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2C3CCS(=O)(=O)C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NN2[C@H]3CCS(=O)(=O)C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C18H21N3O3S/c22-18(19-13-6-2-1-3-7-13)17-15-8-4-5-9-16(15)21(20-17)14-10-11-25(23,24)12-14/h1-3,6-7,14H,4-5,8-12H2,(H,19,22)/t14-/m0/s1