N-[(3S,4R)-6-(5-azanyl-3-phenyl-pyrazol-1-yl)carbonyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-4-ethyl-benzenesulfonamide

Systemtic Name: N-[(3S,4R)-6-(5-azanyl-3-phenyl-pyrazol-1-yl)carbonyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-4-ethyl-benzenesulfonamide Openeye Name: N-[(3S,4R)-6-(5-amino-3-phenyl-pyrazole-1-carbonyl)-3-hydroxy-2,2-dimethyl-chroman-4-yl]-4-ethyl-benzenesulfonamide CAS Name: N-[(3S,4R)-6-[(5-amino-3-phenyl-1-pyrazolyl)-oxomethyl]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-4-ethylbenzenesulfonamide IUPAC Name: N-[(3S,4R)-6-(5-amino-3-phenylpyrazole-1-carbonyl)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-4-ethylbenzenesulfonamide Traditional Name: N-[(3S,4R)-6-(5-amino-3-phenyl-pyrazole-1-carbonyl)-3-hydroxy-2,2-dimethyl-chroman-4-yl]-4-ethyl-benzenesulfonamide Formula: C29H30N4O5S MolecularWeight: 546.6373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2C(C(OC3=C2C=C(C=C3)C(=O)N4C(=CC(=N4)C5=CC=CC=C5)N)(C)C)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N[C@H]2[C@@H](C(OC3=C2C=C(C=C3)C(=O)N4C(=CC(=N4)C5=CC=CC=C5)N)(C)C)O

InChI

InChI=1S/C29H30N4O5S/c1-4-18-10-13-21(14-11-18)39(36,37)32-26-22-16-20(12-15-24(22)38-29(2,3)27(26)34)28(35)33-25(30)17-23(31-33)19-8-6-5-7-9-19/h5-17,26-27,32,34H,4,30H2,1-3H3/t26-,27+/m1/s1