N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-3-propyl-phthalazine-1-carboxamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3N(C4=CC=CC=C4S3)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\3/N(C4=CC=CC=C4S3)C

InChI

InChI=1S/C20H19N5O2S/c1-3-12-25-19(27)14-9-5-4-8-13(14)17(23-25)18(26)21-22-20-24(2)15-10-6-7-11-16(15)28-20/h4-11H,3,12H2,1-2H3,(H,21,26)/b22-20-