5-[[5-cyano-2-[3-(diethylamino)propylcarbamoylamino]pyridin-4-yl]-methyl-amino]indole-1-carboxylic acid

Systemtic Name: 5-[[5-cyano-2-[3-(diethylamino)propylcarbamoylamino]pyridin-4-yl]-methyl-amino]indole-1-carboxylic acid Openeye Name: 5-[[5-cyano-2-[3-(diethylamino)propylcarbamoylamino]-4-pyridyl]-methyl-amino]indole-1-carboxylic acid CAS Name: 5-[[5-cyano-2-[[[3-(diethylamino)propylamino]-oxomethyl]amino]-4-pyridinyl]-methylamino]-1-indolecarboxylic acid IUPAC Name: 5-[[5-cyano-2-[3-(diethylamino)propylcarbamoylamino]pyridin-4-yl]-methylamino]indole-1-carboxylic acid Traditional Name: 5-[[5-cyano-2-[3-(diethylamino)propylcarbamoylamino]-4-pyridyl]-methyl-amino]indole-1-carboxylic acid Formula: C24H29N7O3 MolecularWeight: 463.53216

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)NC1=NC=C(C(=C1)N(C)C2=CC3=C(C=C2)N(C=C3)C(=O)O)C#N

Isomeric SMILES

CCN(CC)CCCNC(=O)NC1=NC=C(C(=C1)N(C)C2=CC3=C(C=C2)N(C=C3)C(=O)O)C#N

InChI

InChI=1S/C24H29N7O3/c1-4-30(5-2)11-6-10-26-23(32)28-22-14-21(18(15-25)16-27-22)29(3)19-7-8-20-17(13-19)9-12-31(20)24(33)34/h7-9,12-14,16H,4-6,10-11H2,1-3H3,(H,33,34)(H2,26,27,28,32)