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

Systemtic Name: N-[3-[bis(azanyl)methylideneamino]propyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-(3-guanidinopropyl)-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[3-(diaminomethylideneamino)propyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[3-(diaminomethylideneamino)propyl]-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(3-guanidinopropyl)-1-methyl-9H-$b-carboline-3-carboxamide Formula: C17H20N6O MolecularWeight: 324.3803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N6O/c1-10-15-12(11-5-2-3-6-13(11)23-15)9-14(22-10)16(24)20-7-4-8-21-17(18)19/h2-3,5-6,9,23H,4,7-8H2,1H3,(H,20,24)(H4,18,19,21)