[1-(3-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl] N'-methyl-N-phenyl-carbamimidothioate

Systemtic Name: [1-(3-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl] N'-methyl-N-phenyl-carbamimidothioate Openeye Name: 2-[1-(3-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]-3-methyl-1-phenyl-isothiourea CAS Name: N'-methyl-N-phenylcarbamimidothioic acid [1-(3-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl] ester IUPAC Name: [1-(3-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl] N'-methyl-N-phenylcarbamimidothioate Traditional Name: 2-[2,5-diketo-1-(3-methoxyphenyl)pyrrolidin-3-yl]-3-methyl-1-phenyl-isothiourea Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NC1=CC=CC=C1)SC2CC(=O)N(C2=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CN=C(NC1=CC=CC=C1)SC2CC(=O)N(C2=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H19N3O3S/c1-20-19(21-13-7-4-3-5-8-13)26-16-12-17(23)22(18(16)24)14-9-6-10-15(11-14)25-2/h3-11,16H,12H2,1-2H3,(H,20,21)