N-[2-(diethylaminomethyl)pyridin-4-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)indole-2-carboxamide

Systemtic Name: N-[2-(diethylaminomethyl)pyridin-4-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)indole-2-carboxamide Openeye Name: N-[2-(diethylaminomethyl)-4-pyridyl]-1-methyl-N-(N-oxocarbamimidoyl)indole-2-carboxamide CAS Name: N-[2-(diethylaminomethyl)-4-pyridinyl]-N-[imino(nitroso)methyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-(diethylaminomethyl)pyridin-4-yl]-1-methyl-N-(N-oxocarbamimidoyl)indole-2-carboxamide Traditional Name: N-[2-(diethylaminomethyl)-4-pyridyl]-N-(N-ketoamidino)-1-methyl-indole-2-carboxamide Formula: C21H24N6O2 MolecularWeight: 392.45426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC=CC(=C1)N(C(=O)C2=CC3=CC=CC=C3N2C)C(=N)N=O

Isomeric SMILES

CCN(CC)CC1=NC=CC(=C1)N(C(=O)C2=CC3=CC=CC=C3N2C)C(=N)N=O

InChI

InChI=1S/C21H24N6O2/c1-4-26(5-2)14-16-13-17(10-11-23-16)27(21(22)24-29)20(28)19-12-15-8-6-7-9-18(15)25(19)3/h6-13,22H,4-5,14H2,1-3H3