ethyl 2-[3-[[1-[2,3-bis(chloranyl)phenyl]-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[[1-[2,3-bis(chloranyl)phenyl]-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]ethanoate Openeye Name: ethyl 2-[3-[[1-(2,3-dichlorophenyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]indol-1-yl]acetate CAS Name: 2-[3-[[1-(2,3-dichlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-1-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[1-(2,3-dichlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetate Traditional Name: 2-[3-[[1-(2,3-dichlorophenyl)-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]indol-1-yl]acetic acid ethyl ester Formula: C23H17Cl2N3O4S MolecularWeight: 502.36978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=C(C(=CC=C4)Cl)Cl

Isomeric SMILES

CCOC(=O)CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=C(C(=CC=C4)Cl)Cl

InChI

InChI=1S/C23H17Cl2N3O4S/c1-2-32-19(29)12-27-11-13(14-6-3-4-8-17(14)27)10-15-21(30)26-23(33)28(22(15)31)18-9-5-7-16(24)20(18)25/h3-11H,2,12H2,1H3,(H,26,30,33)