N-[2-[bis(azanyl)methylideneamino]ethyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[2-[bis(azanyl)methylideneamino]ethyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-(2-guanidinoethyl)-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[2-(diaminomethylideneamino)ethyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[2-(diaminomethylideneamino)ethyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(2-guanidinoethyl)-1-methyl-9H-$b-carboline-3-carboxamide Formula: C16H18N6O MolecularWeight: 310.35372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C(=O)NCCN=C(N)N)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C2C(=CC(=N1)C(=O)NCCN=C(N)N)C3=CC=CC=C3N2

InChI

InChI=1S/C16H18N6O/c1-9-14-11(10-4-2-3-5-12(10)22-14)8-13(21-9)15(23)19-6-7-20-16(17)18/h2-5,8,22H,6-7H2,1H3,(H,19,23)(H4,17,18,20)