4-pyrrolidin-1-yl-N-[6-(4-pyrrolidin-1-ylbutanoylamino)-9-[[4-(3-pyrrolidin-1-ylpropanoylamino)phenyl]amino]acridin-3-yl]butanamide

Systemtic Name: 4-pyrrolidin-1-yl-N-[6-(4-pyrrolidin-1-ylbutanoylamino)-9-[[4-(3-pyrrolidin-1-ylpropanoylamino)phenyl]amino]acridin-3-yl]butanamide Openeye Name: 4-pyrrolidin-1-yl-N-[6-(4-pyrrolidin-1-ylbutanoylamino)-9-[4-(3-pyrrolidin-1-ylpropanoylamino)anilino]acridin-3-yl]butanamide CAS Name: N-[6-[[1-oxo-4-(1-pyrrolidinyl)butyl]amino]-9-[4-[[1-oxo-3-(1-pyrrolidinyl)propyl]amino]anilino]-3-acridinyl]-4-(1-pyrrolidinyl)butanamide IUPAC Name: 4-pyrrolidin-1-yl-N-[6-(4-pyrrolidin-1-ylbutanoylamino)-9-[4-(3-pyrrolidin-1-ylpropanoylamino)anilino]acridin-3-yl]butanamide Traditional Name: 4-pyrrolidino-N-[6-(4-pyrrolidinobutanoylamino)-9-[4-(3-pyrrolidinopropanoylamino)anilino]acridin-3-yl]butyramide Formula: C42H54N8O3 MolecularWeight: 718.92996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCC(=O)NC2=CC3=C(C=C2)C(=C4C=CC(=CC4=N3)NC(=O)CCCN5CCCC5)NC6=CC=C(C=C6)NC(=O)CCN7CCCC7

Isomeric SMILES

C1CCN(C1)CCCC(=O)NC2=CC3=C(C=C2)C(=C4C=CC(=CC4=N3)NC(=O)CCCN5CCCC5)NC6=CC=C(C=C6)NC(=O)CCN7CCCC7

InChI

InChI=1S/C42H54N8O3/c51-39(9-7-26-48-20-1-2-21-48)44-33-15-17-35-37(29-33)47-38-30-34(45-40(52)10-8-27-49-22-3-4-23-49)16-18-36(38)42(35)46-32-13-11-31(12-14-32)43-41(53)19-28-50-24-5-6-25-50/h11-18,29-30H,1-10,19-28H2,(H,43,53)(H,44,51)(H,45,52)(H,46,47)