1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-N-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-N-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: N-benzyl-1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethyl-pyrazole-4-sulfonamide CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-3,5-dimethyl-N-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: N-benzyl-1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethylpyrazole-4-sulfonamide Traditional Name: N-benzyl-1-[(3S)-1,1-diketothiolan-3-yl]-3,5-dimethyl-pyrazole-4-sulfonamide Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1[C@H]2CCS(=O)(=O)C2)C)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C16H21N3O4S2/c1-12-16(25(22,23)17-10-14-6-4-3-5-7-14)13(2)19(18-12)15-8-9-24(20,21)11-15/h3-7,15,17H,8-11H2,1-2H3/t15-/m0/s1