3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(1,4-diketo-3H-phthalazin-2-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C19H16N4O3S/c1-11-5-4-8-14-16(11)21-19(27-14)20-15(24)9-10-23-18(26)13-7-3-2-6-12(13)17(25)22-23/h2-8H,9-10H2,1H3,(H,22,25)(H,20,21,24)