N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H19BrN4O2S MolecularWeight: 483.38086

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=C(S3)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=C(S3)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN4O2S/c1-3-12-27-21(29)17-7-5-4-6-16(17)19(26-27)20(28)25-22-24-18(13(2)30-22)14-8-10-15(23)11-9-14/h4-11H,3,12H2,1-2H3,(H,24,25,28)