1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-(4-dimethylaminophenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-cyclopropyl-N-(4-dimethylaminophenyl)pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-N-(4-dimethylaminophenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-(4-dimethylaminophenyl)-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-(4-dimethylaminophenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]pyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-1-[(3S)-1,1-diketothiolan-3-yl]-N-(4-dimethylaminophenyl)pyrazole-3-carboxamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)C2=NN(C(=C2)C3CC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)C2=NN(C(=C2)C3CC3)[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C19H24N4O3S/c1-22(2)15-7-5-14(6-8-15)20-19(24)17-11-18(13-3-4-13)23(21-17)16-9-10-27(25,26)12-16/h5-8,11,13,16H,3-4,9-10,12H2,1-2H3,(H,20,24)/t16-/m0/s1