N-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-1,1-bis(oxidanylidene)-N-prop-2-enyl-thiolan-3-amine

Systemtic Name: N-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-1,1-bis(oxidanylidene)-N-prop-2-enyl-thiolan-3-amine Openeye Name: N-allyl-N-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-1,1-dioxo-thiolan-3-amine CAS Name: N-[[3-(3-chlorophenyl)-1-methyl-4-pyrazolyl]methyl]-1,1-dioxo-N-prop-2-enyl-3-thiolanamine IUPAC Name: N-[[3-(3-chlorophenyl)-1-methylpyrazol-4-yl]methyl]-1,1-dioxo-N-prop-2-enylthiolan-3-amine Traditional Name: allyl-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-(1,1-diketothiolan-3-yl)amine Formula: C18H22ClN3O2S MolecularWeight: 379.90418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)Cl)CN(CC=C)C3CCS(=O)(=O)C3

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)Cl)CN(CC=C)C3CCS(=O)(=O)C3

InChI

InChI=1S/C18H22ClN3O2S/c1-3-8-22(17-7-9-25(23,24)13-17)12-15-11-21(2)20-18(15)14-5-4-6-16(19)10-14/h3-6,10-11,17H,1,7-9,12-13H2,2H3