(3S,4R)-4-[butyl-(4-ethylphenyl)sulfonyl-amino]-2,2-dimethyl-3-oxidanyl-N-phenethyl-3,4-dihydrochromene-6-carboxamide

Systemtic Name: (3S,4R)-4-[butyl-(4-ethylphenyl)sulfonyl-amino]-2,2-dimethyl-3-oxidanyl-N-phenethyl-3,4-dihydrochromene-6-carboxamide Openeye Name: (3S,4R)-4-[butyl-(4-ethylphenyl)sulfonyl-amino]-3-hydroxy-2,2-dimethyl-N-phenethyl-chromane-6-carboxamide CAS Name: (3S,4R)-4-[butyl-(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-phenethyl-3,4-dihydro-2H-1-benzopyran-6-carboxamide IUPAC Name: (3S,4R)-4-[butyl-(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-phenethyl-3,4-dihydrochromene-6-carboxamide Traditional Name: (3S,4R)-4-[butyl-(4-ethylphenyl)sulfonyl-amino]-3-hydroxy-2,2-dimethyl-N-phenethyl-chroman-6-carboxamide Formula: C32H40N2O5S MolecularWeight: 564.7354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1C(C(OC2=C1C=C(C=C2)C(=O)NCCC3=CC=CC=C3)(C)C)O)S(=O)(=O)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCCN([C@H]1[C@@H](C(OC2=C1C=C(C=C2)C(=O)NCCC3=CC=CC=C3)(C)C)O)S(=O)(=O)C4=CC=C(C=C4)CC

InChI

InChI=1S/C32H40N2O5S/c1-5-7-21-34(40(37,38)26-16-13-23(6-2)14-17-26)29-27-22-25(15-18-28(27)39-32(3,4)30(29)35)31(36)33-20-19-24-11-9-8-10-12-24/h8-18,22,29-30,35H,5-7,19-21H2,1-4H3,(H,33,36)/t29-,30+/m1/s1