2-[1-isoquinolin-1-yl-5-(2-oxidanylideneethenyl)indol-3-yl]guanidine

Systemtic Name: 2-[1-isoquinolin-1-yl-5-(2-oxidanylideneethenyl)indol-3-yl]guanidine Openeye Name: 2-[1-(1-isoquinolyl)-5-(2-oxovinyl)indol-3-yl]guanidine CAS Name: 2-[1-(1-isoquinolinyl)-5-(2-oxoethenyl)-3-indolyl]guanidine IUPAC Name: 2-[1-isoquinolin-1-yl-5-(2-oxoethenyl)indol-3-yl]guanidine Traditional Name: 2-[1-(1-isoquinolyl)-5-(2-ketovinyl)indol-3-yl]guanidine Formula: C20H15N5O MolecularWeight: 341.366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2N3C=C(C4=C3C=CC(=C4)C=C=O)N=C(N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2N3C=C(C4=C3C=CC(=C4)C=C=O)N=C(N)N

InChI

InChI=1S/C20H15N5O/c21-20(22)24-17-12-25(18-6-5-13(8-10-26)11-16(17)18)19-15-4-2-1-3-14(15)7-9-23-19/h1-9,11-12H,(H4,21,22,24)