N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[4-(1H-indol-3-yl)thiazol-2-yl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-(1H-indol-3-yl)-2-thiazolyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[4-(1H-indol-3-yl)thiazol-2-yl]-4-keto-phthalazine-1-carboxamide Formula: C25H23N5O2S MolecularWeight: 457.54742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H23N5O2S/c1-2-3-8-13-30-24(32)18-11-5-4-10-17(18)22(29-30)23(31)28-25-27-21(15-33-25)19-14-26-20-12-7-6-9-16(19)20/h4-7,9-12,14-15,26H,2-3,8,13H2,1H3,(H,27,28,31)