5-[(4-cyanophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-cyanoanilino)-oxomethyl]amino]-N-(3-methoxypropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidino-benzamide Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5O3/c1-31-14-4-11-25-22(29)20-15-19(9-10-21(20)28-12-2-3-13-28)27-23(30)26-18-7-5-17(16-24)6-8-18/h5-10,15H,2-4,11-14H2,1H3,(H,25,29)(H2,26,27,30)