methyl 5-[4-(2-methylpropyl)phenyl]-3-[(oxidanylamino)methylideneamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-[4-(2-methylpropyl)phenyl]-3-[(oxidanylamino)methylideneamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(hydroxyamino)methyleneamino]-5-(4-isobutylphenyl)thiophene-2-carboxylate CAS Name: 3-[(hydroxyamino)methylideneamino]-5-[4-(2-methylpropyl)phenyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(hydroxyamino)methylideneamino]-5-[4-(2-methylpropyl)phenyl]thiophene-2-carboxylate Traditional Name: 3-[(hydroxyamino)methyleneamino]-5-(4-isobutylphenyl)thiophene-2-carboxylic acid methyl ester Formula: C17H20N2O3S MolecularWeight: 332.4173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)N=CNO

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)N=CNO

InChI

InChI=1S/C17H20N2O3S/c1-11(2)8-12-4-6-13(7-5-12)15-9-14(18-10-19-21)16(23-15)17(20)22-3/h4-7,9-11,21H,8H2,1-3H3,(H,18,19)