N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-keto-N-methyl-3-propyl-phthalazine-1-carboxamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4O2S/c1-3-12-25-20(26)15-9-5-4-8-14(15)19(23-25)21(27)24(2)13-18-22-16-10-6-7-11-17(16)28-18/h4-11H,3,12-13H2,1-2H3