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

Systemtic Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-cyanoanilino)-oxomethyl]amino]-N-(2-diethylaminoethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-pyrrolidino-benzamide Formula: C25H32N6O2 MolecularWeight: 448.56058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N6O2/c1-3-30(4-2)15-12-27-24(32)22-17-21(10-11-23(22)31-13-5-6-14-31)29-25(33)28-20-9-7-8-19(16-20)18-26/h7-11,16-17H,3-6,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)