N-(2-azanylethyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-(2-azanylethyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-(2-aminoethyl)-3-[(4-tert-butylbenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-(2-aminoethyl)-3-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-(2-aminoethyl)-3-[(4-tert-butylbenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-(2-aminoethyl)-3-[(4-tert-butylbenzoyl)amino]-4-(pyrrolidinomethyl)benzamide Formula: C25H34N4O2 MolecularWeight: 422.56306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NCCN)CN3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NCCN)CN3CCCC3

InChI

InChI=1S/C25H34N4O2/c1-25(2,3)21-10-8-18(9-11-21)24(31)28-22-16-19(23(30)27-13-12-26)6-7-20(22)17-29-14-4-5-15-29/h6-11,16H,4-5,12-15,17,26H2,1-3H3,(H,27,30)(H,28,31)