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

Systemtic Name: 5-[(5-bromanyl-2-methyl-1H-indol-3-yl)methylidene]-1-[2-(cyclohexen-1-yl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylene]-1-[2-(cyclohexen-1-yl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylidene]-1-[2-(1-cyclohexenyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylidene]-1-[2-(cyclohexen-1-yl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylene]-1-[2-(cyclohexen-1-yl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)Br)C=C3C(=O)NC(=S)N(C3=O)CCC4=CCCCC4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)Br)C=C3C(=O)NC(=S)N(C3=O)CCC4=CCCCC4

InChI

InChI=1S/C22H22BrN3O2S/c1-13-16(17-11-15(23)7-8-19(17)24-13)12-18-20(27)25-22(29)26(21(18)28)10-9-14-5-3-2-4-6-14/h5,7-8,11-12,24H,2-4,6,9-10H2,1H3,(H,25,27,29)