1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(2,3-dimethylphenyl)-1-methyl-thiourea

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(2,3-dimethylphenyl)-1-methyl-thiourea Openeye Name: 3-(2,3-dimethylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-1-methyl-thiourea CAS Name: 3-(2,3-dimethylphenyl)-1-[(3S)-1,1-dioxo-3-thiolanyl]-1-methylthiourea IUPAC Name: 3-(2,3-dimethylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-1-methylthiourea Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-3-(2,3-dimethylphenyl)-1-methyl-thiourea Formula: C14H20N2O2S2 MolecularWeight: 312.4508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N(C)C2CCS(=O)(=O)C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N(C)[C@H]2CCS(=O)(=O)C2)C

InChI

InChI=1S/C14H20N2O2S2/c1-10-5-4-6-13(11(10)2)15-14(19)16(3)12-7-8-20(17,18)9-12/h4-6,12H,7-9H2,1-3H3,(H,15,19)/t12-/m0/s1