N-(1,3-benzothiazol-2-yl)-2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-cyclohexyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-cyclohexyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-cyclohexyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-cyclohexyl-1,3-diketo-isoindoline-5-carboxamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N3O3S/c26-19(24-22-23-17-8-4-5-9-18(17)29-22)13-10-11-15-16(12-13)21(28)25(20(15)27)14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7H2,(H,23,24,26)