N-[1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-3,5-dimethyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-3,5-dimethyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3CCS(=O)(=O)C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3CCS(=O)(=O)C3)C

InChI

InChI=1S/C18H23N3O3S/c1-12-4-6-15(7-5-12)10-21-14(3)17(13(2)20-21)18(22)19-16-8-9-25(23,24)11-16/h4-7,16H,8-11H2,1-3H3,(H,19,22)