(5Z)-1-[4-(1-adamantyl)phenyl]-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: (5Z)-1-[4-(1-adamantyl)phenyl]-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: (5Z)-1-[4-(1-adamantyl)phenyl]-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5Z)-1-[4-(1-adamantyl)phenyl]-5-[[1-[(2-chlorophenyl)methyl]-3-indolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: (5Z)-1-[4-(1-adamantyl)phenyl]-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: (5Z)-1-[4-(1-adamantyl)phenyl]-5-[[1-(2-chlorobenzyl)indol-3-yl]methylene]barbituric acid Formula: C36H32ClN3O3 MolecularWeight: 590.11058

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)N5C(=O)C(=CC6=CN(C7=CC=CC=C76)CC8=CC=CC=C8Cl)C(=O)NC5=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)N5C(=O)/C(=C\C6=CN(C7=CC=CC=C76)CC8=CC=CC=C8Cl)/C(=O)NC5=O

InChI

InChI=1S/C36H32ClN3O3/c37-31-7-3-1-5-25(31)20-39-21-26(29-6-2-4-8-32(29)39)16-30-33(41)38-35(43)40(34(30)42)28-11-9-27(10-12-28)36-17-22-13-23(18-36)15-24(14-22)19-36/h1-12,16,21-24H,13-15,17-20H2,(H,38,41,43)/b30-16-