4-azanyl-9-(2-morpholin-4-ylethyl)-N-prop-2-enyl-pyrimido[4,5-b]indole-2-carboxamide

Systemtic Name: 4-azanyl-9-(2-morpholin-4-ylethyl)-N-prop-2-enyl-pyrimido[4,5-b]indole-2-carboxamide Openeye Name: N-allyl-4-amino-9-(2-morpholinoethyl)pyrimido[4,5-b]indole-2-carboxamide CAS Name: 4-amino-9-[2-(4-morpholinyl)ethyl]-N-prop-2-enyl-2-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 4-amino-9-(2-morpholin-4-ylethyl)-N-prop-2-enylpyrimido[4,5-b]indole-2-carboxamide Traditional Name: N-allyl-4-amino-9-(2-morpholinoethyl)pyrimid[4,5-b]indole-2-carboxamide Formula: C20H24N6O2 MolecularWeight: 380.44356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=NC2=C(C3=CC=CC=C3N2CCN4CCOCC4)C(=N1)N

Isomeric SMILES

C=CCNC(=O)C1=NC2=C(C3=CC=CC=C3N2CCN4CCOCC4)C(=N1)N

InChI

InChI=1S/C20H24N6O2/c1-2-7-22-20(27)18-23-17(21)16-14-5-3-4-6-15(14)26(19(16)24-18)9-8-25-10-12-28-13-11-25/h2-6H,1,7-13H2,(H,22,27)(H2,21,23,24)