[3-[4-[(3-cyano-1H-indol-5-yl)-ethyl-carbamoyl]phenyl]-3-methyl-butyl]carbamic acid

Systemtic Name: [3-[4-[(3-cyano-1H-indol-5-yl)-ethyl-carbamoyl]phenyl]-3-methyl-butyl]carbamic acid Openeye Name: [3-[4-[(3-cyano-1H-indol-5-yl)-ethyl-carbamoyl]phenyl]-3-methyl-butyl]carbamic acid CAS Name: [3-[4-[[(3-cyano-1H-indol-5-yl)-ethylamino]-oxomethyl]phenyl]-3-methylbutyl]carbamic acid IUPAC Name: [3-[4-[(3-cyano-1H-indol-5-yl)-ethylcarbamoyl]phenyl]-3-methylbutyl]carbamic acid Traditional Name: [3-[4-[(3-cyano-1H-indol-5-yl)-ethyl-carbamoyl]phenyl]-3-methyl-butyl]carbamic acid Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)NC=C2C#N)C(=O)C3=CC=C(C=C3)C(C)(C)CCNC(=O)O

Isomeric SMILES

CCN(C1=CC2=C(C=C1)NC=C2C#N)C(=O)C3=CC=C(C=C3)C(C)(C)CCNC(=O)O

InChI

InChI=1S/C24H26N4O3/c1-4-28(19-9-10-21-20(13-19)17(14-25)15-27-21)22(29)16-5-7-18(8-6-16)24(2,3)11-12-26-23(30)31/h5-10,13,15,26-27H,4,11-12H2,1-3H3,(H,30,31)