N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-propylindol-3-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-propylindol-3-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-propylindol-3-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-propyl-3-indolyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-propylindol-3-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-propylindol-3-yl)thio]acetamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)SCC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)SCC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H22N2O3S/c1-2-9-23-13-20(16-5-3-4-6-17(16)23)27-14-21(24)22-15-7-8-18-19(12-15)26-11-10-25-18/h3-8,12-13H,2,9-11,14H2,1H3,(H,22,24)