N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[(E)-[1-methyl-2-[5-(methylamino)-1,2,4-thiadiazol-3-yl]ethylidene]amino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(E)-[1-methyl-2-[5-(methylamino)-1,2,4-thiadiazol-3-yl]ethylidene]amino]phthalazine-1-carboxamide Formula: C18H21N7O2S MolecularWeight: 399.47004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)CC3=NSC(=N3)NC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(\C)/CC3=NSC(=N3)NC

InChI

InChI=1S/C18H21N7O2S/c1-10(2)25-17(27)13-8-6-5-7-12(13)15(23-25)16(26)22-21-11(3)9-14-20-18(19-4)28-24-14/h5-8,10H,9H2,1-4H3,(H,22,26)(H,19,20,24)/b21-11+