N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-2-(2-thienyl)cinchoninamide Formula: C21H21N3OS MolecularWeight: 363.47594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

C[C@H]\1CCCC/C1=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C21H21N3OS/c1-14-7-2-4-9-17(14)23-24-21(25)16-13-19(20-11-6-12-26-20)22-18-10-5-3-8-15(16)18/h3,5-6,8,10-14H,2,4,7,9H2,1H3,(H,24,25)/b23-17-/t14-/m0/s1