methyl 3-[[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-1H-indole-2-carboxylate Openeye Name: methyl 3-[(4,6-dioxo-1-phenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-1H-indole-2-carboxylate CAS Name: 3-[(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-1H-indole-2-carboxylate Traditional Name: 3-[(4,6-diketo-1-phenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-1H-indole-2-carboxylic acid methyl ester Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H15N3O4S/c1-28-20(27)17-14(13-9-5-6-10-16(13)22-17)11-15-18(25)23-21(29)24(19(15)26)12-7-3-2-4-8-12/h2-11,22H,1H3,(H,23,25,29)