methyl 2-[3-[(E)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[(E)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]indol-1-yl]ethanoate Openeye Name: methyl 2-[3-[(E)-(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]indol-1-yl]acetate CAS Name: 2-[3-[(E)-(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(E)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]indol-1-yl]acetate Traditional Name: 2-[3-[(E)-(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]indol-1-yl]acetic acid methyl ester Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N3

Isomeric SMILES

COC(=O)CN1C=C(C2=CC=CC=C21)/C=C/3\C(=O)NC(=S)N3

InChI

InChI=1S/C15H13N3O3S/c1-21-13(19)8-18-7-9(10-4-2-3-5-12(10)18)6-11-14(20)17-15(22)16-11/h2-7H,8H2,1H3,(H2,16,17,20,22)/b11-6+