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

Systemtic Name: 1-(4-aminophenyl)-3-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]thiourea Openeye Name: 1-(4-aminophenyl)-3-[(1,1-dioxothiolan-3-yl)methyl]thiourea CAS Name: 1-(4-aminophenyl)-3-[(1,1-dioxo-3-thiolanyl)methyl]thiourea IUPAC Name: 1-(4-aminophenyl)-3-[(1,1-dioxothiolan-3-yl)methyl]thiourea Traditional Name: 1-(4-aminophenyl)-3-[(1,1-diketothiolan-3-yl)methyl]thiourea Formula: C12H17N3O2S2 MolecularWeight: 299.41228

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1CNC(=S)NC2=CC=C(C=C2)N

Isomeric SMILES

C1CS(=O)(=O)CC1CNC(=S)NC2=CC=C(C=C2)N

InChI

InChI=1S/C12H17N3O2S2/c13-10-1-3-11(4-2-10)15-12(18)14-7-9-5-6-19(16,17)8-9/h1-4,9H,5-8,13H2,(H2,14,15,18)