tert-butyl 3-[5-azanyl-2-(6-cyanonaphthalen-2-yl)oxy-phenyl]thiophene-2-carboxylate

Systemtic Name: tert-butyl 3-[5-azanyl-2-(6-cyanonaphthalen-2-yl)oxy-phenyl]thiophene-2-carboxylate Openeye Name: tert-butyl 3-[5-amino-2-[(6-cyano-2-naphthyl)oxy]phenyl]thiophene-2-carboxylate CAS Name: 3-[5-amino-2-[(6-cyano-2-naphthalenyl)oxy]phenyl]-2-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[5-amino-2-(6-cyanonaphthalen-2-yl)oxyphenyl]thiophene-2-carboxylate Traditional Name: 3-[5-amino-2-(6-cyano-2-naphthoxy)phenyl]thiophene-2-carboxylic acid tert-butyl ester Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CS1)C2=C(C=CC(=C2)N)OC3=CC4=C(C=C3)C=C(C=C4)C#N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CS1)C2=C(C=CC(=C2)N)OC3=CC4=C(C=C3)C=C(C=C4)C#N

InChI

InChI=1S/C26H22N2O3S/c1-26(2,3)31-25(29)24-21(10-11-32-24)22-14-19(28)7-9-23(22)30-20-8-6-17-12-16(15-27)4-5-18(17)13-20/h4-14H,28H2,1-3H3