(4S)-6-azanyl-4-(2-chloranyl-6-fluoranyl-phenyl)-1-methyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: (4S)-6-azanyl-4-(2-chloranyl-6-fluoranyl-phenyl)-1-methyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4S)-6-amino-4-(2-chloro-6-fluoro-phenyl)-1-methyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4S)-6-amino-4-(2-chloro-6-fluorophenyl)-1-methyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4S)-6-amino-4-(2-chloro-6-fluorophenyl)-1-methyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4S)-6-amino-4-(2-chloro-6-fluoro-phenyl)-1-methyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C17H16ClFN4O MolecularWeight: 346.786543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CCCC1=NN(C2=C1[C@@H](C(=C(O2)N)C#N)C3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C17H16ClFN4O/c1-3-5-12-15-13(14-10(18)6-4-7-11(14)19)9(8-20)16(21)24-17(15)23(2)22-12/h4,6-7,13H,3,5,21H2,1-2H3/t13-/m0/s1