2-[(4-tert-butylphenyl)sulfonyl-(3-methoxypropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-tert-butylphenyl)sulfonyl-(3-methoxypropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-tert-butylphenyl)sulfonyl-(3-methoxypropyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[(4-tert-butylphenyl)sulfonyl-(3-methoxypropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-tert-butylphenyl)sulfonyl-(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[(4-tert-butylphenyl)sulfonyl-(3-methoxypropyl)amino]-N-(2-thenyl)acetamide Formula: C28H36N2O4S2 MolecularWeight: 528.72644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CCCOC)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CCCOC)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C28H36N2O4S2/c1-28(2,3)24-13-15-26(16-14-24)36(32,33)30(17-9-18-34-4)22-27(31)29(21-25-12-8-19-35-25)20-23-10-6-5-7-11-23/h5-8,10-16,19H,9,17-18,20-22H2,1-4H3