3-[1-oxidanylidene-3,4-diphenyl-2-(5-phenyl-1,3,4-thiadiazol-2-yl)isoquinolin-6-yl]-2-[(E)-2-phenylethenyl]quinazolin-4-one

Systemtic Name: 3-[1-oxidanylidene-3,4-diphenyl-2-(5-phenyl-1,3,4-thiadiazol-2-yl)isoquinolin-6-yl]-2-[(E)-2-phenylethenyl]quinazolin-4-one Openeye Name: 3-[1-oxo-3,4-diphenyl-2-(5-phenyl-1,3,4-thiadiazol-2-yl)-6-isoquinolyl]-2-[(E)-styryl]quinazolin-4-one CAS Name: 3-[1-oxo-3,4-diphenyl-2-(5-phenyl-1,3,4-thiadiazol-2-yl)-6-isoquinolinyl]-2-[(E)-2-phenylethenyl]-4-quinazolinone IUPAC Name: 3-[1-oxo-3,4-diphenyl-2-(5-phenyl-1,3,4-thiadiazol-2-yl)isoquinolin-6-yl]-2-[(E)-2-phenylethenyl]quinazolin-4-one Traditional Name: 3-[1-keto-3,4-diphenyl-2-(5-phenyl-1,3,4-thiadiazol-2-yl)-6-isoquinolyl]-2-[(E)-styryl]quinazolin-4-one Formula: C45H29N5O2S MolecularWeight: 703.80906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=NC3=CC=CC=C3C(=O)N2C4=CC5=C(C=C4)C(=O)N(C(=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=NN=C(S8)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=O)N2C4=CC5=C(C=C4)C(=O)N(C(=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=NN=C(S8)C9=CC=CC=C9

InChI

InChI=1S/C45H29N5O2S/c51-43-35-27-26-34(49-39(28-25-30-15-5-1-6-16-30)46-38-24-14-13-23-36(38)44(49)52)29-37(35)40(31-17-7-2-8-18-31)41(32-19-9-3-10-20-32)50(43)45-48-47-42(53-45)33-21-11-4-12-22-33/h1-29H/b28-25+