(E)-3-[3-(cyclopropylamino)-6-phenyl-6-thiophen-3-yl-7H-indazol-1-yl]prop-2-enal

Systemtic Name: (E)-3-[3-(cyclopropylamino)-6-phenyl-6-thiophen-3-yl-7H-indazol-1-yl]prop-2-enal Openeye Name: (E)-3-[3-(cyclopropylamino)-6-phenyl-6-(3-thienyl)-7H-indazol-1-yl]prop-2-enal CAS Name: (E)-3-[3-(cyclopropylamino)-6-phenyl-6-(3-thiophenyl)-7H-indazol-1-yl]-2-propenal IUPAC Name: (E)-3-[3-(cyclopropylamino)-6-phenyl-6-thiophen-3-yl-7H-indazol-1-yl]prop-2-enal Traditional Name: (E)-3-[3-(cyclopropylamino)-6-phenyl-6-(3-thienyl)-7H-indazol-1-yl]acrolein Formula: C23H21N3OS MolecularWeight: 387.49734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NN(C3=C2C=CC(C3)(C4=CC=CC=C4)C5=CSC=C5)C=CC=O

Isomeric SMILES

C1CC1NC2=NN(C3=C2C=CC(C3)(C4=CC=CC=C4)C5=CSC=C5)/C=C/C=O

InChI

InChI=1S/C23H21N3OS/c27-13-4-12-26-21-15-23(18-10-14-28-16-18,17-5-2-1-3-6-17)11-9-20(21)22(25-26)24-19-7-8-19/h1-6,9-14,16,19H,7-8,15H2,(H,24,25)/b12-4+