N-phenyl-3-[[3-(phenylcarbamoyl)-5-(2-pyrrolidin-1-ylethanoylamino)phenyl]carbamoylamino]-5-(2-pyrrolidin-1-ylethanoylamino)benzamide

Systemtic Name: N-phenyl-3-[[3-(phenylcarbamoyl)-5-(2-pyrrolidin-1-ylethanoylamino)phenyl]carbamoylamino]-5-(2-pyrrolidin-1-ylethanoylamino)benzamide Openeye Name: N-phenyl-3-[[3-(phenylcarbamoyl)-5-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]carbamoylamino]-5-[(2-pyrrolidin-1-ylacetyl)amino]benzamide CAS Name: 3-[[[3-[anilino(oxo)methyl]-5-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]anilino]-oxomethyl]amino]-5-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]-N-phenylbenzamide IUPAC Name: N-phenyl-3-[[3-(phenylcarbamoyl)-5-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]carbamoylamino]-5-[(2-pyrrolidin-1-ylacetyl)amino]benzamide Traditional Name: N-phenyl-3-[[3-(phenylcarbamoyl)-5-[(2-pyrrolidinoacetyl)amino]phenyl]carbamoylamino]-5-[(2-pyrrolidinoacetyl)amino]benzamide Formula: C39H42N8O5 MolecularWeight: 702.80138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)NC2=CC(=CC(=C2)C(=O)NC3=CC=CC=C3)NC(=O)NC4=CC(=CC(=C4)NC(=O)CN5CCCC5)C(=O)NC6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CC(=O)NC2=CC(=CC(=C2)C(=O)NC3=CC=CC=C3)NC(=O)NC4=CC(=CC(=C4)NC(=O)CN5CCCC5)C(=O)NC6=CC=CC=C6

InChI

InChI=1S/C39H42N8O5/c48-35(25-46-15-7-8-16-46)40-31-19-27(37(50)42-29-11-3-1-4-12-29)21-33(23-31)44-39(52)45-34-22-28(38(51)43-30-13-5-2-6-14-30)20-32(24-34)41-36(49)26-47-17-9-10-18-47/h1-6,11-14,19-24H,7-10,15-18,25-26H2,(H,40,48)(H,41,49)(H,42,50)(H,43,51)(H2,44,45,52)