2-[(4-tert-butylphenyl)sulfonyl-(4-methylphenyl)amino]-N-(3-oxidanylpropyl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(4-tert-butylphenyl)sulfonyl-(4-methylphenyl)amino]-N-(3-oxidanylpropyl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-(N-(4-tert-butylphenyl)sulfonyl-4-methyl-anilino)-N-(3-hydroxypropyl)-N-(3-pyridylmethyl)acetamide CAS Name: 2-(N-(4-tert-butylphenyl)sulfonyl-4-methylanilino)-N-(3-hydroxypropyl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-(N-(4-tert-butylphenyl)sulfonyl-4-methylanilino)-N-(3-hydroxypropyl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-(N-(4-tert-butylphenyl)sulfonyl-4-methyl-anilino)-N-(3-hydroxypropyl)-N-(3-pyridylmethyl)acetamide Formula: C28H35N3O4S MolecularWeight: 509.6602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)N(CCCO)CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)N(CCCO)CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H35N3O4S/c1-22-8-12-25(13-9-22)31(36(34,35)26-14-10-24(11-15-26)28(2,3)4)21-27(33)30(17-6-18-32)20-23-7-5-16-29-19-23/h5,7-16,19,32H,6,17-18,20-21H2,1-4H3