4-(3-azanylpiperidin-1-yl)-9H-pyrimido[4,5-b]indole-6-carboxamide

Systemtic Name: 4-(3-azanylpiperidin-1-yl)-9H-pyrimido[4,5-b]indole-6-carboxamide Openeye Name: 4-(3-amino-1-piperidyl)-9H-pyrimido[4,5-b]indole-6-carboxamide CAS Name: 4-(3-amino-1-piperidinyl)-9H-pyrimido[4,5-b]indole-6-carboxamide IUPAC Name: 4-(3-aminopiperidin-1-yl)-9H-pyrimido[4,5-b]indole-6-carboxamide Traditional Name: 4-(3-aminopiperidino)-9H-pyrimid[4,5-b]indole-6-carboxamide Formula: C16H18N6O MolecularWeight: 310.35372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N)N

Isomeric SMILES

C1CC(CN(C1)C2=NC=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N)N

InChI

InChI=1S/C16H18N6O/c17-10-2-1-5-22(7-10)16-13-11-6-9(14(18)23)3-4-12(11)21-15(13)19-8-20-16/h3-4,6,8,10H,1-2,5,7,17H2,(H2,18,23)(H,19,20,21)