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

Systemtic Name: 2-[butan-2-yl-(4-nitrophenyl)sulfonyl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[(3-methyl-2-thienyl)methyl]-2-[(4-nitrophenyl)sulfonyl-sec-butyl-amino]acetamide CAS Name: 2-[butan-2-yl-(4-nitrophenyl)sulfonylamino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[butan-2-yl-(4-nitrophenyl)sulfonylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-N-[(3-methyl-2-thienyl)methyl]-2-[nosyl(sec-butyl)amino]acetamide Formula: C25H29N3O5S2 MolecularWeight: 515.64486

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(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

CCC(C)N(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/C25H29N3O5S2/c1-4-20(3)27(35(32,33)23-12-10-22(11-13-23)28(30)31)18-25(29)26(16-21-8-6-5-7-9-21)17-24-19(2)14-15-34-24/h5-15,20H,4,16-18H2,1-3H3