O-[2-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl] N-(4-methoxyphenyl)carbamothioate

Systemtic Name: O-[2-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl] N-(4-methoxyphenyl)carbamothioate Openeye Name: O-[2-(5-methyl-1,3-dioxo-isoindolin-2-yl)ethyl] N-(4-methoxyphenyl)carbamothioate CAS Name: N-(4-methoxyphenyl)carbamothioic acid O-[2-(5-methyl-1,3-dioxo-2-isoindolyl)ethyl] ester IUPAC Name: O-[2-(5-methyl-1,3-dioxoisoindol-2-yl)ethyl] N-(4-methoxyphenyl)carbamothioate Traditional Name: N-(4-methoxyphenyl)thiocarbamic acid O-[2-(1,3-diketo-5-methyl-isoindolin-2-yl)ethyl] ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCOC(=S)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCOC(=S)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H18N2O4S/c1-12-3-8-15-16(11-12)18(23)21(17(15)22)9-10-25-19(26)20-13-4-6-14(24-2)7-5-13/h3-8,11H,9-10H2,1-2H3,(H,20,26)