N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-2-thiazolyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-3-amyl-4-keto-phthalazine-1-carboxamide Formula: C24H25N5O3S2 MolecularWeight: 495.617

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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(S4)CNC(=O)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC=C(S4)CNC(=O)C

InChI

InChI=1S/C24H25N5O3S2/c1-3-4-7-12-29-23(32)18-9-6-5-8-17(18)21(28-29)22(31)27-24-26-19(14-33-24)20-11-10-16(34-20)13-25-15(2)30/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3,(H,25,30)(H,26,27,31)