N-[(2-azanyl-5-cyano-phenyl)methyl]-N-(1-phenoxy-3-phenyl-propan-2-yl)thiophene-2-sulfonamide

Systemtic Name: N-[(2-azanyl-5-cyano-phenyl)methyl]-N-(1-phenoxy-3-phenyl-propan-2-yl)thiophene-2-sulfonamide Openeye Name: N-[(2-amino-5-cyano-phenyl)methyl]-N-(1-benzyl-2-phenoxy-ethyl)thiophene-2-sulfonamide CAS Name: N-[(2-amino-5-cyanophenyl)methyl]-N-(1-phenoxy-3-phenylpropan-2-yl)-2-thiophenesulfonamide IUPAC Name: N-[(2-amino-5-cyanophenyl)methyl]-N-(1-phenoxy-3-phenylpropan-2-yl)thiophene-2-sulfonamide Traditional Name: N-(2-amino-5-cyano-benzyl)-N-(1-benzyl-2-phenoxy-ethyl)thiophene-2-sulfonamide Formula: C27H25N3O3S2 MolecularWeight: 503.6357

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(COC2=CC=CC=C2)N(CC3=C(C=CC(=C3)C#N)N)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CC(COC2=CC=CC=C2)N(CC3=C(C=CC(=C3)C#N)N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C27H25N3O3S2/c28-18-22-13-14-26(29)23(16-22)19-30(35(31,32)27-12-7-15-34-27)24(17-21-8-3-1-4-9-21)20-33-25-10-5-2-6-11-25/h1-16,24H,17,19-20,29H2