1-(3-methylphenyl)-5-[(1-propylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-methylphenyl)-5-[(1-propylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(m-tolyl)-5-[(1-propylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-methylphenyl)-5-[(1-propyl-3-indolyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-methylphenyl)-5-[(1-propylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(m-tolyl)-5-[(1-propylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C

InChI

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