5-methyl-1,1-bis(oxidanylidene)-2-(phenylsulfanylmethyl)-4-propyl-1,2,5-thiadiazolidin-3-one

Systemtic Name: 5-methyl-1,1-bis(oxidanylidene)-2-(phenylsulfanylmethyl)-4-propyl-1,2,5-thiadiazolidin-3-one Openeye Name: 5-methyl-1,1-dioxo-2-(phenylsulfanylmethyl)-4-propyl-1,2,5-thiadiazolidin-3-one CAS Name: 5-methyl-1,1-dioxo-2-[(phenylthio)methyl]-4-propyl-1,2,5-thiadiazolidin-3-one IUPAC Name: 5-methyl-1,1-dioxo-2-(phenylsulfanylmethyl)-4-propyl-1,2,5-thiadiazolidin-3-one Traditional Name: 1,1-diketo-5-methyl-2-[(phenylthio)methyl]-4-propyl-1,2,5-thiadiazolidin-3-one Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(S(=O)(=O)N1C)CSC2=CC=CC=C2

Isomeric SMILES

CCCC1C(=O)N(S(=O)(=O)N1C)CSC2=CC=CC=C2

InChI

InChI=1S/C13H18N2O3S2/c1-3-7-12-13(16)15(20(17,18)14(12)2)10-19-11-8-5-4-6-9-11/h4-6,8-9,12H,3,7,10H2,1-2H3