1-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-oxidanyl-3-propan-2-yl-urea

Systemtic Name: 1-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-oxidanyl-3-propan-2-yl-urea Openeye Name: 1-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dimethyl-2-thioxo-thiazolidin-4-yl]-1-hydroxy-3-isopropyl-urea CAS Name: 1-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dimethyl-2-sulfanylidene-4-thiazolidinyl]-1-hydroxy-3-propan-2-ylurea IUPAC Name: 1-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxy-3-propan-2-ylurea Traditional Name: 1-[(4S)-5,5-dimethyl-3-piperonyl-2-thioxo-thiazolidin-4-yl]-1-hydroxy-3-isopropyl-urea Formula: C17H23N3O4S2 MolecularWeight: 397.51222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N(C1C(SC(=S)N1CC2=CC3=C(C=C2)OCO3)(C)C)O

Isomeric SMILES

CC(C)NC(=O)N([C@H]1C(SC(=S)N1CC2=CC3=C(C=C2)OCO3)(C)C)O

InChI

InChI=1S/C17H23N3O4S2/c1-10(2)18-15(21)20(22)14-17(3,4)26-16(25)19(14)8-11-5-6-12-13(7-11)24-9-23-12/h5-7,10,14,22H,8-9H2,1-4H3,(H,18,21)/t14-/m0/s1