1-(3-methoxyphenyl)-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-methoxyphenyl)-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-methoxyphenyl)-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-methoxyphenyl)-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-methoxyphenyl)-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-methoxyphenyl)-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H16N4O5S MolecularWeight: 436.44054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C21H16N4O5S/c1-11-15(16-9-13(25(28)29)6-7-18(16)22-11)10-17-19(26)23-21(31)24(20(17)27)12-4-3-5-14(8-12)30-2/h3-10,22H,1-2H3,(H,23,26,31)