N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-(morpholinomethyl)thiazol-2-yl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-(4-morpholinylmethyl)-2-thiazolyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-(morpholinomethyl)thiazol-2-yl]-3-phenyl-phthalazine-1-carboxamide Formula: C23H21N5O3S MolecularWeight: 447.50954

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1CC2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C23H21N5O3S/c29-21(25-23-24-16(15-32-23)14-27-10-12-31-13-11-27)20-18-8-4-5-9-19(18)22(30)28(26-20)17-6-2-1-3-7-17/h1-9,15H,10-14H2,(H,24,25,29)