N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]butanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]butyramide Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=C(C=C1)OCCO2)SC3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCC(C(=O)NC1=CC2=C(C=C1)OCCO2)SC3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C21H22N2O4S2/c1-3-18(20(24)22-13-5-8-16-17(11-13)27-10-9-26-16)28-21-23-15-7-6-14(25-4-2)12-19(15)29-21/h5-8,11-12,18H,3-4,9-10H2,1-2H3,(H,22,24)