3-pyrrolidin-1-yl-N-[9-[[4-(2-pyrrolidin-1-ylethanoylamino)phenyl]amino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]propanamide

Systemtic Name: 3-pyrrolidin-1-yl-N-[9-[[4-(2-pyrrolidin-1-ylethanoylamino)phenyl]amino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]propanamide Openeye Name: 3-pyrrolidin-1-yl-N-[9-[4-[(2-pyrrolidin-1-ylacetyl)amino]anilino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]propanamide CAS Name: N-[9-[4-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]anilino]-6-[[1-oxo-3-(1-pyrrolidinyl)propyl]amino]-3-acridinyl]-3-(1-pyrrolidinyl)propanamide IUPAC Name: 3-pyrrolidin-1-yl-N-[9-[4-[(2-pyrrolidin-1-ylacetyl)amino]anilino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]propanamide Traditional Name: 3-pyrrolidino-N-[9-[4-[(2-pyrrolidinoacetyl)amino]anilino]-6-(3-pyrrolidinopropanoylamino)acridin-3-yl]propionamide Formula: C39H48N8O3 MolecularWeight: 676.85022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC(=O)NC2=CC3=C(C=C2)C(=C4C=CC(=CC4=N3)NC(=O)CCN5CCCC5)NC6=CC=C(C=C6)NC(=O)CN7CCCC7

Isomeric SMILES

C1CCN(C1)CCC(=O)NC2=CC3=C(C=C2)C(=C4C=CC(=CC4=N3)NC(=O)CCN5CCCC5)NC6=CC=C(C=C6)NC(=O)CN7CCCC7

InChI

InChI=1S/C39H48N8O3/c48-36(15-23-45-17-1-2-18-45)41-30-11-13-32-34(25-30)44-35-26-31(42-37(49)16-24-46-19-3-4-20-46)12-14-33(35)39(32)43-29-9-7-28(8-10-29)40-38(50)27-47-21-5-6-22-47/h7-14,25-26H,1-6,15-24,27H2,(H,40,50)(H,41,48)(H,42,49)(H,43,44)