N,N-bis(cyanomethyl)-4-(2-quinolin-2-yl-1H-indol-3-yl)butanamide

Systemtic Name: N,N-bis(cyanomethyl)-4-(2-quinolin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N,N-bis(cyanomethyl)-4-[2-(2-quinolyl)-1H-indol-3-yl]butanamide CAS Name: N,N-bis(cyanomethyl)-4-[2-(2-quinolinyl)-1H-indol-3-yl]butanamide IUPAC Name: N,N-bis(cyanomethyl)-4-(2-quinolin-2-yl-1H-indol-3-yl)butanamide Traditional Name: N,N-bis(cyanomethyl)-4-[2-(2-quinolyl)-1H-indol-3-yl]butyramide Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=C(C4=CC=CC=C4N3)CCCC(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=C(C4=CC=CC=C4N3)CCCC(=O)N(CC#N)CC#N

InChI

InChI=1S/C25H21N5O/c26-14-16-30(17-15-27)24(31)11-5-8-20-19-7-2-4-10-22(19)29-25(20)23-13-12-18-6-1-3-9-21(18)28-23/h1-4,6-7,9-10,12-13,29H,5,8,11,16-17H2