N-(2-azanylcyclohexyl)-3-[(4-methylphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(4-methylphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-(2-aminocyclohexyl)-3-[(4-methylbenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[(4-methylphenyl)-oxomethyl]amino]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-[(4-methylbenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-(2-aminocyclohexyl)-3-(p-toluoylamino)-4-(pyrrolidinomethyl)benzamide Formula: C26H34N4O2 MolecularWeight: 434.57376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCCC4

InChI

InChI=1S/C26H34N4O2/c1-18-8-10-19(11-9-18)25(31)29-24-16-20(12-13-21(24)17-30-14-4-5-15-30)26(32)28-23-7-3-2-6-22(23)27/h8-13,16,22-23H,2-7,14-15,17,27H2,1H3,(H,28,32)(H,29,31)