N-[9-[(3-methylphenyl)methylamino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-yl-propanamide

Systemtic Name: N-[9-[(3-methylphenyl)methylamino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-yl-propanamide Openeye Name: N-[9-(m-tolylmethylamino)-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-yl-propanamide CAS Name: N-[9-[(3-methylphenyl)methylamino]-6-[[1-oxo-3-(1-pyrrolidinyl)propyl]amino]-3-acridinyl]-3-(1-pyrrolidinyl)propanamide IUPAC Name: N-[9-[(3-methylphenyl)methylamino]-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-ylpropanamide Traditional Name: N-[9-[(3-methylbenzyl)amino]-6-(3-pyrrolidinopropanoylamino)acridin-3-yl]-3-pyrrolidino-propionamide Formula: C35H42N6O2 MolecularWeight: 578.74698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)NC(=O)CCN5CCCC5)NC(=O)CCN6CCCC6

Isomeric SMILES

CC1=CC(=CC=C1)CNC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)NC(=O)CCN5CCCC5)NC(=O)CCN6CCCC6

InChI

InChI=1S/C35H42N6O2/c1-25-7-6-8-26(21-25)24-36-35-29-11-9-27(37-33(42)13-19-40-15-2-3-16-40)22-31(29)39-32-23-28(10-12-30(32)35)38-34(43)14-20-41-17-4-5-18-41/h6-12,21-23H,2-5,13-20,24H2,1H3,(H,36,39)(H,37,42)(H,38,43)