2-[butan-2-yl(quinolin-8-ylsulfonyl)amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[butan-2-yl(quinolin-8-ylsulfonyl)amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[(3-methyl-2-thienyl)methyl]-2-[8-quinolylsulfonyl(sec-butyl)amino]acetamide CAS Name: 2-[butan-2-yl(8-quinolinylsulfonyl)amino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[butan-2-yl(quinolin-8-ylsulfonyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-N-[(3-methyl-2-thienyl)methyl]-2-[8-quinolylsulfonyl(sec-butyl)amino]acetamide Formula: C28H31N3O3S2 MolecularWeight: 521.69404

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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=CC4=C3N=CC=C4

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C28H31N3O3S2/c1-4-22(3)31(36(33,34)26-14-8-12-24-13-9-16-29-28(24)26)20-27(32)30(18-23-10-6-5-7-11-23)19-25-21(2)15-17-35-25/h5-17,22H,4,18-20H2,1-3H3