[4-[(E)-(5-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] 2-chloranylbenzoate

Systemtic Name: [4-[(E)-(5-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] 2-chloranylbenzoate Openeye Name: [4-[(E)-(1-allyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [4-[(E)-(5-oxo-1-prop-2-enyl-2-sulfanylidene-4-imidazolidinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [4-[(E)-(1-allyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] ester Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3Cl)NC1=S

Isomeric SMILES

C=CCN1C(=O)/C(=C\C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3Cl)/NC1=S

InChI

InChI=1S/C20H15ClN2O3S/c1-2-11-23-18(24)17(22-20(23)27)12-13-7-9-14(10-8-13)26-19(25)15-5-3-4-6-16(15)21/h2-10,12H,1,11H2,(H,22,27)/b17-12+