2-azanyl-4-piperidin-1-yl-9H-pyrimido[4,5-b]indole-6-carboxamide

Systemtic Name: 2-azanyl-4-piperidin-1-yl-9H-pyrimido[4,5-b]indole-6-carboxamide Openeye Name: 2-amino-4-(1-piperidyl)-9H-pyrimido[4,5-b]indole-6-carboxamide CAS Name: 2-amino-4-(1-piperidinyl)-9H-pyrimido[4,5-b]indole-6-carboxamide IUPAC Name: 2-amino-4-piperidin-1-yl-9H-pyrimido[4,5-b]indole-6-carboxamide Traditional Name: 2-amino-4-piperidino-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:

C1CCN(CC1)C2=NC(=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N)N

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N)N

InChI

InChI=1S/C16H18N6O/c17-13(23)9-4-5-11-10(8-9)12-14(19-11)20-16(18)21-15(12)22-6-2-1-3-7-22/h4-5,8H,1-3,6-7H2,(H2,17,23)(H3,18,19,20,21)