N-[(2S)-2-morpholin-4-ium-4-yl-2-pyridin-2-yl-ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide

Systemtic Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-pyridin-2-yl-ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide Openeye Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-pyridyl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide CAS Name: N-[(2S)-2-(4-morpholin-4-iumyl)-2-(2-pyridinyl)ethyl]-2-(1-pyrrolidinyl)-5,6,7,8-tetrahydroquinazoline-4-carboxamide IUPAC Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-pyridin-2-ylethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide Traditional Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-pyridyl)ethyl]-2-pyrrolidino-5,6,7,8-tetrahydroquinazoline-4-carboxamide Formula: C24H33N6O2+ MolecularWeight: 437.55782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC(=NC(=C2C1)C(=O)NCC(C3=CC=CC=N3)[NH+]4CCOCC4)N5CCCC5

Isomeric SMILES

C1CCC2=NC(=NC(=C2C1)C(=O)NC[C@@H](C3=CC=CC=N3)[NH+]4CCOCC4)N5CCCC5

InChI

InChI=1S/C24H32N6O2/c31-23(26-17-21(20-9-3-4-10-25-20)29-13-15-32-16-14-29)22-18-7-1-2-8-19(18)27-24(28-22)30-11-5-6-12-30/h3-4,9-10,21H,1-2,5-8,11-17H2,(H,26,31)/p+1/t21-/m0/s1