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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-furylmethyl(2-thienylmethyl)amino]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-furanylmethyl(thiophen-2-ylmethyl)amino]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-furfuryl(2-thenyl)amino]acetamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CN(CC3=CC=CO3)CC4=CC=CS4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CN(CC3=CC=CO3)CC4=CC=CS4)OC1

InChI

InChI=1S/C21H22N2O4S/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/h1-2,4-8,11-12H,3,9-10,13-15H2,(H,22,24)