2-[3-ethoxypropyl-(4-nitrophenyl)sulfonyl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-ethoxypropyl-(4-nitrophenyl)sulfonyl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-ethoxypropyl-(4-nitrophenyl)sulfonyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[3-ethoxypropyl-(4-nitrophenyl)sulfonylamino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-ethoxypropyl-(4-nitrophenyl)sulfonylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[3-ethoxypropyl(nosyl)amino]-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C26H31N3O6S2 MolecularWeight: 545.67084

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H31N3O6S2/c1-3-35-16-7-15-28(37(33,34)24-12-10-23(11-13-24)29(31)32)20-26(30)27(18-22-8-5-4-6-9-22)19-25-21(2)14-17-36-25/h4-6,8-14,17H,3,7,15-16,18-20H2,1-2H3