N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-(3-chloro-4-methoxyphenyl)-2-thiazolyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-4-keto-phthalazine-1-carboxamide Formula: C24H23ClN4O3S MolecularWeight: 482.98242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C24H23ClN4O3S/c1-3-4-7-12-29-23(31)17-9-6-5-8-16(17)21(28-29)22(30)27-24-26-19(14-33-24)15-10-11-20(32-2)18(25)13-15/h5-6,8-11,13-14H,3-4,7,12H2,1-2H3,(H,26,27,30)