3-cyclohexyl-2-[(E)-2-[1-(phenylmethyl)indol-3-yl]ethenyl]quinazolin-4-one

Systemtic Name: 3-cyclohexyl-2-[(E)-2-[1-(phenylmethyl)indol-3-yl]ethenyl]quinazolin-4-one Openeye Name: 2-[(E)-2-(1-benzylindol-3-yl)vinyl]-3-cyclohexyl-quinazolin-4-one CAS Name: 3-cyclohexyl-2-[(E)-2-[1-(phenylmethyl)-3-indolyl]ethenyl]-4-quinazolinone IUPAC Name: 2-[(E)-2-(1-benzylindol-3-yl)ethenyl]-3-cyclohexylquinazolin-4-one Traditional Name: 2-[(E)-2-(1-benzylindol-3-yl)vinyl]-3-cyclohexyl-quinazolin-4-one Formula: C31H29N3O MolecularWeight: 459.58146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C31H29N3O/c35-31-27-16-7-9-17-28(27)32-30(34(31)25-13-5-2-6-14-25)20-19-24-22-33(21-23-11-3-1-4-12-23)29-18-10-8-15-26(24)29/h1,3-4,7-12,15-20,22,25H,2,5-6,13-14,21H2/b20-19+