N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2,3-diphenyl-3,4-dihydropyrazole-5-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2,3-diphenyl-3,4-dihydropyrazole-5-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2,3-diphenyl-3,4-dihydropyrazole-5-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-2,3-diphenyl-3,4-dihydropyrazole-5-carboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2,3-diphenyl-3,4-dihydropyrazole-5-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-methyl-1,5-diphenyl-2-pyrazoline-3-carboxamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C2=NN(C(C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)C2=NN(C(C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S/c1-23(18-12-13-28(26,27)15-18)21(25)19-14-20(16-8-4-2-5-9-16)24(22-19)17-10-6-3-7-11-17/h2-11,18,20H,12-15H2,1H3