N-[2-[[4-(2-azanyl-2-azanylidene-ethyl)phenyl]methyl]-3-oxidanylidene-1H-isoindol-4-yl]-5-chloranyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[[4-(2-azanyl-2-azanylidene-ethyl)phenyl]methyl]-3-oxidanylidene-1H-isoindol-4-yl]-5-chloranyl-thiophene-2-carboxamide Openeye Name: N-[2-[[4-(2-amino-2-imino-ethyl)phenyl]methyl]-3-oxo-isoindolin-4-yl]-5-chloro-thiophene-2-carboxamide CAS Name: N-[2-[[4-(2-amino-2-iminoethyl)phenyl]methyl]-3-oxo-1H-isoindol-4-yl]-5-chloro-2-thiophenecarboxamide IUPAC Name: N-[2-[[4-(2-amino-2-iminoethyl)phenyl]methyl]-3-oxo-1H-isoindol-4-yl]-5-chlorothiophene-2-carboxamide Traditional Name: N-[2-[4-(2-amino-2-imino-ethyl)benzyl]-3-keto-isoindolin-4-yl]-5-chloro-thiophene-2-carboxamide Formula: C22H19ClN4O2S MolecularWeight: 438.92986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC=C2)NC(=O)C3=CC=C(S3)Cl)C(=O)N1CC4=CC=C(C=C4)CC(=N)N

Isomeric SMILES

C1C2=C(C(=CC=C2)NC(=O)C3=CC=C(S3)Cl)C(=O)N1CC4=CC=C(C=C4)CC(=N)N

InChI

InChI=1S/C22H19ClN4O2S/c23-18-9-8-17(30-18)21(28)26-16-3-1-2-15-12-27(22(29)20(15)16)11-14-6-4-13(5-7-14)10-19(24)25/h1-9H,10-12H2,(H3,24,25)(H,26,28)