N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide Openeye Name: 2-benzyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxamide IUPAC Name: 2-benzyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-(6-methyl-1,3-benzothiazol-2-yl)isoindoline-5-carboxamide Formula: C24H17N3O3S MolecularWeight: 427.47508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C24H17N3O3S/c1-14-7-10-19-20(11-14)31-24(25-19)26-21(28)16-8-9-17-18(12-16)23(30)27(22(17)29)13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,25,26,28)