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

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2C3CCS(=O)(=O)C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NN2[C@H]3CCS(=O)(=O)C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C20H25N3O3S/c24-20(21-12-10-15-6-2-1-3-7-15)19-17-8-4-5-9-18(17)23(22-19)16-11-13-27(25,26)14-16/h1-3,6-7,16H,4-5,8-14H2,(H,21,24)/t16-/m0/s1