1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-(3,4-dimethylphenyl)-3-phenyl-urea

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-(3,4-dimethylphenyl)-3-phenyl-urea Openeye Name: 1-(3,4-dimethylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-3-phenyl-urea CAS Name: 1-(3,4-dimethylphenyl)-1-[(3S)-1,1-dioxo-3-thiolanyl]-3-phenylurea IUPAC Name: 1-(3,4-dimethylphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]-3-phenylurea Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-1-(3,4-dimethylphenyl)-3-phenyl-urea Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N([C@H]2CCS(=O)(=O)C2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N2O3S/c1-14-8-9-17(12-15(14)2)21(18-10-11-25(23,24)13-18)19(22)20-16-6-4-3-5-7-16/h3-9,12,18H,10-11,13H2,1-2H3,(H,20,22)/t18-/m0/s1