N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCNC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17N5O2S/c1-24-18(26)13-7-3-2-6-12(13)16(23-24)17(25)20-10-11-21-19-22-14-8-4-5-9-15(14)27-19/h2-9H,10-11H2,1H3,(H,20,25)(H,21,22)