N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[tetrahydrofuran-2-ylmethyl(2-thienylmethyl)amino]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-oxolanylmethyl(thiophen-2-ylmethyl)amino]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[tetrahydrofurfuryl(2-thenyl)amino]acetamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=CS2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=CS2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H26N2O4S/c24-21(22-16-6-7-19-20(12-16)27-10-3-9-26-19)15-23(13-17-4-1-8-25-17)14-18-5-2-11-28-18/h2,5-7,11-12,17H,1,3-4,8-10,13-15H2,(H,22,24)