2-[[5-bromanyl-2-(2-methylpropoxy)phenyl]methylideneamino]-N-(furan-2-ylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[[5-bromanyl-2-(2-methylpropoxy)phenyl]methylideneamino]-N-(furan-2-ylmethyl)thiophene-3-carboxamide Openeye Name: 2-[(5-bromo-2-isobutoxy-phenyl)methyleneamino]-N-(2-furylmethyl)thiophene-3-carboxamide CAS Name: 2-[[5-bromo-2-(2-methylpropoxy)phenyl]methylideneamino]-N-(2-furanylmethyl)-3-thiophenecarboxamide IUPAC Name: 2-[[5-bromo-2-(2-methylpropoxy)phenyl]methylideneamino]-N-(furan-2-ylmethyl)thiophene-3-carboxamide Traditional Name: 2-[(5-bromo-2-isobutoxy-benzylidene)amino]-N-(2-furfuryl)thiophene-3-carboxamide Formula: C21H21BrN2O3S MolecularWeight: 461.37204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C=NC2=C(C=CS2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C=NC2=C(C=CS2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H21BrN2O3S/c1-14(2)13-27-19-6-5-16(22)10-15(19)11-24-21-18(7-9-28-21)20(25)23-12-17-4-3-8-26-17/h3-11,14H,12-13H2,1-2H3,(H,23,25)