N-(2-methyl-1,3-benzothiazol-6-yl)-3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(5-methyl-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(5-methyl-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(5-methyl-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: 3-(1,3-diketo-5-methyl-isoindolin-2-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)propionamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)NC3=CC4=C(C=C3)N=C(S4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)NC3=CC4=C(C=C3)N=C(S4)C

InChI

InChI=1S/C20H17N3O3S/c1-11-3-5-14-15(9-11)20(26)23(19(14)25)8-7-18(24)22-13-4-6-16-17(10-13)27-12(2)21-16/h3-6,9-10H,7-8H2,1-2H3,(H,22,24)