3-carbamimidoyl-N-[[1-[4-(2-methyl-1-morpholin-4-yl-propan-2-yl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methyl]benzamide

Systemtic Name: 3-carbamimidoyl-N-[[1-[4-(2-methyl-1-morpholin-4-yl-propan-2-yl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methyl]benzamide Openeye Name: 3-carbamimidoyl-N-[[1-[4-(1,1-dimethyl-2-morpholino-ethyl)phenyl]-5-oxo-pyrrolidin-3-yl]methyl]benzamide CAS Name: 3-carbamimidoyl-N-[[1-[4-[2-methyl-1-(4-morpholinyl)propan-2-yl]phenyl]-5-oxo-3-pyrrolidinyl]methyl]benzamide IUPAC Name: 3-carbamimidoyl-N-[[1-[4-(2-methyl-1-morpholin-4-ylpropan-2-yl)phenyl]-5-oxopyrrolidin-3-yl]methyl]benzamide Traditional Name: 3-amidino-N-[[1-[4-(1,1-dimethyl-2-morpholino-ethyl)phenyl]-5-keto-pyrrolidin-3-yl]methyl]benzamide Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCOCC1)C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC(C)(CN1CCOCC1)C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C27H35N5O3/c1-27(2,18-31-10-12-35-13-11-31)22-6-8-23(9-7-22)32-17-19(14-24(32)33)16-30-26(34)21-5-3-4-20(15-21)25(28)29/h3-9,15,19H,10-14,16-18H2,1-2H3,(H3,28,29)(H,30,34)