(5Z)-1-(4-methoxyphenyl)-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-1-(4-methoxyphenyl)-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-5-[(1-benzylindol-3-yl)methylene]-1-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-1-(4-methoxyphenyl)-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-5-[(1-benzylindol-3-yl)methylidene]-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-5-[(1-benzylindol-3-yl)methylene]-1-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C27H21N3O3S MolecularWeight: 467.53894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C(=O)NC2=S

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)/C(=O)NC2=S

InChI

InChI=1S/C27H21N3O3S/c1-33-21-13-11-20(12-14-21)30-26(32)23(25(31)28-27(30)34)15-19-17-29(16-18-7-3-2-4-8-18)24-10-6-5-9-22(19)24/h2-15,17H,16H2,1H3,(H,28,31,34)/b23-15-