4-oxidanylidene-N-phenethyl-N-(4-phenyl-1,3-thiazol-2-yl)-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-phenethyl-N-(4-phenyl-1,3-thiazol-2-yl)-3-propyl-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-phenethyl-N-(4-phenylthiazol-2-yl)-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-phenethyl-N-(4-phenyl-2-thiazolyl)-3-propyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-phenethyl-N-(4-phenyl-1,3-thiazol-2-yl)-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-phenethyl-N-(4-phenylthiazol-2-yl)-3-propyl-phthalazine-1-carboxamide Formula: C29H26N4O2S MolecularWeight: 494.60734

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CCC3=CC=CC=C3)C4=NC(=CS4)C5=CC=CC=C5

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CCC3=CC=CC=C3)C4=NC(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N4O2S/c1-2-18-33-27(34)24-16-10-9-15-23(24)26(31-33)28(35)32(19-17-21-11-5-3-6-12-21)29-30-25(20-36-29)22-13-7-4-8-14-22/h3-16,20H,2,17-19H2,1H3