4-[(2-chloranyl-5-methoxy-phenyl)amino]-5-[5-(piperidin-1-ylmethyl)-1-benzofuran-2-yl]pyridine-3-carbonitrile

Systemtic Name: 4-[(2-chloranyl-5-methoxy-phenyl)amino]-5-[5-(piperidin-1-ylmethyl)-1-benzofuran-2-yl]pyridine-3-carbonitrile Openeye Name: 4-(2-chloro-5-methoxy-anilino)-5-[5-(1-piperidylmethyl)benzofuran-2-yl]pyridine-3-carbonitrile CAS Name: 4-(2-chloro-5-methoxyanilino)-5-[5-(1-piperidinylmethyl)-2-benzofuranyl]-3-pyridinecarbonitrile IUPAC Name: 4-(2-chloro-5-methoxyanilino)-5-[5-(piperidin-1-ylmethyl)-1-benzofuran-2-yl]pyridine-3-carbonitrile Traditional Name: 4-(2-chloro-5-methoxy-anilino)-5-[5-(piperidinomethyl)benzofuran-2-yl]nicotinonitrile Formula: C27H25ClN4O2 MolecularWeight: 472.966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)NC2=C(C=NC=C2C#N)C3=CC4=C(O3)C=CC(=C4)CN5CCCCC5

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)NC2=C(C=NC=C2C#N)C3=CC4=C(O3)C=CC(=C4)CN5CCCCC5

InChI

InChI=1S/C27H25ClN4O2/c1-33-21-6-7-23(28)24(13-21)31-27-20(14-29)15-30-16-22(27)26-12-19-11-18(5-8-25(19)34-26)17-32-9-3-2-4-10-32/h5-8,11-13,15-16H,2-4,9-10,17H2,1H3,(H,30,31)