N-[1-(cyanomethylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-4-(1H-indol-3-yl)butanamide

Systemtic Name: N-[1-(cyanomethylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-4-(1H-indol-3-yl)butanamide Openeye Name: N-[2-(cyanomethylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-4-(1H-indol-3-yl)butanamide CAS Name: N-[1-(cyanomethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-(1H-indol-3-yl)butanamide IUPAC Name: N-[1-(cyanomethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-(1H-indol-3-yl)butanamide Traditional Name: N-[2-(cyanomethylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-4-(1H-indol-3-yl)butyramide Formula: C25H25N5O2 MolecularWeight: 427.4983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)NCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)NCC#N

InChI

InChI=1S/C25H25N5O2/c26-12-13-27-25(32)23(14-18-16-29-22-10-4-2-8-20(18)22)30-24(31)11-5-6-17-15-28-21-9-3-1-7-19(17)21/h1-4,7-10,15-16,23,28-29H,5-6,11,13-14H2,(H,27,32)(H,30,31)