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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NCC2CCS(=O)(=O)C2

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NCC2CCS(=O)(=O)C2

InChI

InChI=1S/C13H18N2O3S2/c1-18-12-4-2-3-11(7-12)15-13(19)14-8-10-5-6-20(16,17)9-10/h2-4,7,10H,5-6,8-9H2,1H3,(H2,14,15,19)