5-[(3-cyanophenyl)carbamoylamino]-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-methoxyethyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-cyanoanilino)-oxomethyl]amino]-N-(2-methoxyethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-methoxyethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-methoxyethyl)-2-pyrrolidino-benzamide Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC(=C2)C#N)N3CCCC3

Isomeric SMILES

COCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC(=C2)C#N)N3CCCC3

InChI

InChI=1S/C22H25N5O3/c1-30-12-9-24-21(28)19-14-18(7-8-20(19)27-10-2-3-11-27)26-22(29)25-17-6-4-5-16(13-17)15-23/h4-8,13-14H,2-3,9-12H2,1H3,(H,24,28)(H2,25,26,29)