3-acetamido-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(2-thienyl)propionamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)CC(C3=CC=CS3)NC(=O)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)CC(C3=CC=CS3)NC(=O)C

InChI

InChI=1S/C20H24N2O4S/c1-13(15-6-7-17-18(11-15)26-9-4-8-25-17)21-20(24)12-16(22-14(2)23)19-5-3-10-27-19/h3,5-7,10-11,13,16H,4,8-9,12H2,1-2H3,(H,21,24)(H,22,23)