N-[3-cyano-1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[(2-oxidanylidene-1H-quinazolin-4-yl)amino]propanamide

Systemtic Name: N-[3-cyano-1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[(2-oxidanylidene-1H-quinazolin-4-yl)amino]propanamide Openeye Name: N-[3-cyano-1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[(2-oxo-1H-quinazolin-4-yl)amino]propanamide CAS Name: N-[3-cyano-1-(cyclopentylmethyl)-3-pyrrolidinyl]-3-cyclohexyl-2-[(2-oxo-1H-quinazolin-4-yl)amino]propanamide IUPAC Name: N-[3-cyano-1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[(2-oxo-1H-quinazolin-4-yl)amino]propanamide Traditional Name: N-[3-cyano-1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[(2-keto-1H-quinazolin-4-yl)amino]propionamide Formula: C28H38N6O2 MolecularWeight: 490.64032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CCN(C2)CC3CCCC3)C#N)NC4=NC(=O)NC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CCN(C2)CC3CCCC3)C#N)NC4=NC(=O)NC5=CC=CC=C54

InChI

InChI=1S/C28H38N6O2/c29-18-28(14-15-34(19-28)17-21-10-4-5-11-21)33-26(35)24(16-20-8-2-1-3-9-20)30-25-22-12-6-7-13-23(22)31-27(36)32-25/h6-7,12-13,20-21,24H,1-5,8-11,14-17,19H2,(H,33,35)(H2,30,31,32,36)