5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]-1-(4-isopropylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]-1-p-cumenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCC(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C26H28N4O2S/c1-4-19(13-18-14-28-23-8-6-5-7-21(18)23)27-15-22-24(31)29-26(33)30(25(22)32)20-11-9-17(10-12-20)16(2)3/h5-12,14-16,19,27-28H,4,13H2,1-3H3,(H,29,31,33)