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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=S)NC2=CC=C(C=C2)N

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=S)NC2=CC=C(C=C2)N

InChI

InChI=1S/C12H17N3O2S2/c1-12(6-7-19(16,17)8-12)15-11(18)14-10-4-2-9(13)3-5-10/h2-5H,6-8,13H2,1H3,(H2,14,15,18)