4-(1H-indol-5-ylamino)-2-[3-(pyrrolidin-1-ylmethyl)phenyl]thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 4-(1H-indol-5-ylamino)-2-[3-(pyrrolidin-1-ylmethyl)phenyl]thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 4-(1H-indol-5-ylamino)-2-[3-(pyrrolidin-1-ylmethyl)phenyl]thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 4-(1H-indol-5-ylamino)-2-[3-(1-pyrrolidinylmethyl)phenyl]-5-thieno[2,3-b]pyridinecarbonitrile IUPAC Name: 4-(1H-indol-5-ylamino)-2-[3-(pyrrolidin-1-ylmethyl)phenyl]thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 4-(1H-indol-5-ylamino)-2-[3-(pyrrolidinomethyl)phenyl]thieno[2,3-b]pyridine-5-carbonitrile Formula: C27H23N5S MolecularWeight: 449.57002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC(=C2)C3=CC4=C(C(=CN=C4S3)C#N)NC5=CC6=C(C=C5)NC=C6

Isomeric SMILES

C1CCN(C1)CC2=CC=CC(=C2)C3=CC4=C(C(=CN=C4S3)C#N)NC5=CC6=C(C=C5)NC=C6

InChI

InChI=1S/C27H23N5S/c28-15-21-16-30-27-23(26(21)31-22-6-7-24-19(13-22)8-9-29-24)14-25(33-27)20-5-3-4-18(12-20)17-32-10-1-2-11-32/h3-9,12-14,16,29H,1-2,10-11,17H2,(H,30,31)