5-[3-(2-chlorophenyl)-4-methoxy-phenyl]-4-(1H-indol-5-ylamino)pyridine-3-carbonitrile

Systemtic Name: 5-[3-(2-chlorophenyl)-4-methoxy-phenyl]-4-(1H-indol-5-ylamino)pyridine-3-carbonitrile Openeye Name: 5-[3-(2-chlorophenyl)-4-methoxy-phenyl]-4-(1H-indol-5-ylamino)pyridine-3-carbonitrile CAS Name: 5-[3-(2-chlorophenyl)-4-methoxyphenyl]-4-(1H-indol-5-ylamino)-3-pyridinecarbonitrile IUPAC Name: 5-[3-(2-chlorophenyl)-4-methoxyphenyl]-4-(1H-indol-5-ylamino)pyridine-3-carbonitrile Traditional Name: 5-[3-(2-chlorophenyl)-4-methoxy-phenyl]-4-(1H-indol-5-ylamino)nicotinonitrile Formula: C27H19ClN4O MolecularWeight: 450.91896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=CN=C2)C#N)NC3=CC4=C(C=C3)NC=C4)C5=CC=CC=C5Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=CN=C2)C#N)NC3=CC4=C(C=C3)NC=C4)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H19ClN4O/c1-33-26-9-6-17(13-22(26)21-4-2-3-5-24(21)28)23-16-30-15-19(14-29)27(23)32-20-7-8-25-18(12-20)10-11-31-25/h2-13,15-16,31H,1H3,(H,30,32)