N-(1,3-benzothiazol-2-ylmethyl)-2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-butyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-butyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-butyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-butyl-1,3-diketo-isoindoline-5-carboxamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O3S/c1-2-3-10-24-20(26)14-9-8-13(11-15(14)21(24)27)19(25)22-12-18-23-16-6-4-5-7-17(16)28-18/h4-9,11H,2-3,10,12H2,1H3,(H,22,25)