3-hexyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-hexyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-hexyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-hexyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-hexyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxophthalazine-1-carboxamide Traditional Name: 3-hexyl-4-keto-N-(3-methyl-1,3-benzothiazol-2-ylidene)phthalazine-1-carboxamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N=C3N(C4=CC=CC=C4S3)C

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N=C3N(C4=CC=CC=C4S3)C

InChI

InChI=1S/C23H24N4O2S/c1-3-4-5-10-15-27-22(29)17-12-7-6-11-16(17)20(25-27)21(28)24-23-26(2)18-13-8-9-14-19(18)30-23/h6-9,11-14H,3-5,10,15H2,1-2H3