1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(4-methoxyphenyl)-1-methyl-thiourea

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(4-methoxyphenyl)-1-methyl-thiourea Openeye Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-3-(4-methoxyphenyl)-1-methyl-thiourea CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-3-(4-methoxyphenyl)-1-methylthiourea IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-3-(4-methoxyphenyl)-1-methylthiourea Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-3-(4-methoxyphenyl)-1-methyl-thiourea Formula: C13H18N2O3S2 MolecularWeight: 314.42362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=S)NC2=CC=C(C=C2)OC

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=S)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C13H18N2O3S2/c1-15(11-7-8-20(16,17)9-11)13(19)14-10-3-5-12(18-2)6-4-10/h3-6,11H,7-9H2,1-2H3,(H,14,19)/t11-/m0/s1