4-[(2E)-2-(cyanomethylidene)spiro[1H-indole-3,1'-cyclohexane]-5-yl]thiophene-2-carbonitrile

Systemtic Name: 4-[(2E)-2-(cyanomethylidene)spiro[1H-indole-3,1'-cyclohexane]-5-yl]thiophene-2-carbonitrile Openeye Name: 4-[(2'E)-2'-(cyanomethylene)spiro[cyclohexane-1,3'-indoline]-5'-yl]thiophene-2-carbonitrile CAS Name: 4-[(2E)-2-(cyanomethylidene)-5-spiro[1H-indole-3,1'-cyclohexane]yl]-2-thiophenecarbonitrile IUPAC Name: 4-[(2E)-2-(cyanomethylidene)spiro[1H-indole-3,1'-cyclohexane]-5-yl]thiophene-2-carbonitrile Traditional Name: 4-[(2'E)-2'-(cyanomethylene)spiro[cyclohexane-1,3'-indoline]-5'-yl]thiophene-2-carbonitrile Formula: C20H17N3S MolecularWeight: 331.43408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=C(C=CC(=C3)C4=CSC(=C4)C#N)NC2=CC#N

Isomeric SMILES

C1CCC\2(CC1)C3=C(C=CC(=C3)C4=CSC(=C4)C#N)N/C2=C/C#N

InChI

InChI=1S/C20H17N3S/c21-9-6-19-20(7-2-1-3-8-20)17-11-14(4-5-18(17)23-19)15-10-16(12-22)24-13-15/h4-6,10-11,13,23H,1-3,7-8H2/b19-6+