3-hexyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-hexyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-hexyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-hexyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-hexyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-hexyl-4-keto-N-(5-methyl-1,3,4-thiadiazol-2-yl)phthalazine-1-carboxamide Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)C

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)C

InChI

InChI=1S/C18H21N5O2S/c1-3-4-5-8-11-23-17(25)14-10-7-6-9-13(14)15(22-23)16(24)19-18-21-20-12(2)26-18/h6-7,9-10H,3-5,8,11H2,1-2H3,(H,19,21,24)