N-(1,3-benzothiazol-2-ylmethyl)-2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(1,4-diketo-3H-phthalazin-2-yl)acetamide Formula: C18H14N4O3S MolecularWeight: 366.39376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CC(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CC(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H14N4O3S/c23-15(19-9-16-20-13-7-3-4-8-14(13)26-16)10-22-18(25)12-6-2-1-5-11(12)17(24)21-22/h1-8H,9-10H2,(H,19,23)(H,21,24)