4-azanyl-5-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]-2-[(3-methoxyphenyl)amino]thiophene-3-carbonitrile

Systemtic Name: 4-azanyl-5-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]-2-[(3-methoxyphenyl)amino]thiophene-3-carbonitrile Openeye Name: 4-amino-5-(5-chlorobenzofuran-2-carbonyl)-2-(3-methoxyanilino)thiophene-3-carbonitrile CAS Name: 4-amino-5-[(5-chloro-2-benzofuranyl)-oxomethyl]-2-(3-methoxyanilino)-3-thiophenecarbonitrile IUPAC Name: 4-amino-5-(5-chloro-1-benzofuran-2-carbonyl)-2-(3-methoxyanilino)thiophene-3-carbonitrile Traditional Name: 4-amino-5-(5-chlorobenzofuran-2-carbonyl)-2-(m-anisidino)thiophene-3-carbonitrile Formula: C21H14ClN3O3S MolecularWeight: 423.87216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=C(S2)C(=O)C3=CC4=C(O3)C=CC(=C4)Cl)N)C#N

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=C(S2)C(=O)C3=CC4=C(O3)C=CC(=C4)Cl)N)C#N

InChI

InChI=1S/C21H14ClN3O3S/c1-27-14-4-2-3-13(9-14)25-21-15(10-23)18(24)20(29-21)19(26)17-8-11-7-12(22)5-6-16(11)28-17/h2-9,25H,24H2,1H3