1-(4-butylphenyl)-5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-butylphenyl)-5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-butylphenyl)-5-(1H-indol-3-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-butylphenyl)-5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-butylphenyl)-5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(4-butylphenyl)-5-(1H-indol-3-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=CC3=CNC4=CC=CC=C43)C(=O)NC2=S

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=CC3=CNC4=CC=CC=C43)C(=O)NC2=S

InChI

InChI=1S/C23H21N3O2S/c1-2-3-6-15-9-11-17(12-10-15)26-22(28)19(21(27)25-23(26)29)13-16-14-24-20-8-5-4-7-18(16)20/h4-5,7-14,24H,2-3,6H2,1H3,(H,25,27,29)