1-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-3-[(4-pyrazol-1-ylphenyl)methyl]urea

Systemtic Name: 1-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-3-[(4-pyrazol-1-ylphenyl)methyl]urea Openeye Name: 1-[(1,1-dioxothiolan-3-yl)methyl]-3-[(4-pyrazol-1-ylphenyl)methyl]urea CAS Name: 1-[(1,1-dioxo-3-thiolanyl)methyl]-3-[[4-(1-pyrazolyl)phenyl]methyl]urea IUPAC Name: 1-[(1,1-dioxothiolan-3-yl)methyl]-3-[(4-pyrazol-1-ylphenyl)methyl]urea Traditional Name: 1-[(1,1-diketothiolan-3-yl)methyl]-3-(4-pyrazol-1-ylbenzyl)urea Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1CNC(=O)NCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C1CS(=O)(=O)CC1CNC(=O)NCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C16H20N4O3S/c21-16(18-11-14-6-9-24(22,23)12-14)17-10-13-2-4-15(5-3-13)20-8-1-7-19-20/h1-5,7-8,14H,6,9-12H2,(H2,17,18,21)