N-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-keto-3-methyl-N-p-phenetyl-phthalazine-1-carboxamide Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=NN(C(=O)C5=CC=CC=C54)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=NN(C(=O)C5=CC=CC=C54)C

InChI

InChI=1S/C25H20N4O3S/c1-3-32-17-14-12-16(13-15-17)29(25-26-20-10-6-7-11-21(20)33-25)24(31)22-18-8-4-5-9-19(18)23(30)28(2)27-22/h4-15H,3H2,1-2H3