6-azanyl-7-ethoxy-4-[[1-(phenylmethyl)-2,3-dihydroindol-5-yl]amino]quinoline-3-carbonitrile

Systemtic Name: 6-azanyl-7-ethoxy-4-[[1-(phenylmethyl)-2,3-dihydroindol-5-yl]amino]quinoline-3-carbonitrile Openeye Name: 6-amino-4-[(1-benzylindolin-5-yl)amino]-7-ethoxy-quinoline-3-carbonitrile CAS Name: 6-amino-7-ethoxy-4-[[1-(phenylmethyl)-2,3-dihydroindol-5-yl]amino]-3-quinolinecarbonitrile IUPAC Name: 6-amino-4-[(1-benzyl-2,3-dihydroindol-5-yl)amino]-7-ethoxyquinoline-3-carbonitrile Traditional Name: 6-amino-4-[(1-benzylindolin-5-yl)amino]-7-ethoxy-quinoline-3-carbonitrile Formula: C27H25N5O MolecularWeight: 435.5203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC4=C(C=C3)N(CC4)CC5=CC=CC=C5)C#N)N

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC4=C(C=C3)N(CC4)CC5=CC=CC=C5)C#N)N

InChI

InChI=1S/C27H25N5O/c1-2-33-26-14-24-22(13-23(26)29)27(20(15-28)16-30-24)31-21-8-9-25-19(12-21)10-11-32(25)17-18-6-4-3-5-7-18/h3-9,12-14,16H,2,10-11,17,29H2,1H3,(H,30,31)