2-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-thienylmethyl)acetamide CAS Name: 2-(1-azepanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-thenyl)acetamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCCN(CC1)CC(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H26N2O3S/c24-21(16-22-9-3-1-2-4-10-22)23(15-18-6-5-13-27-18)17-7-8-19-20(14-17)26-12-11-25-19/h5-8,13-14H,1-4,9-12,15-16H2