(2S)-2-(1,3-benzothiazol-2-ylamino)-N-[[(2S)-2-methylcyclohexylidene]amino]propanamide

Systemtic Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[[(2S)-2-methylcyclohexylidene]amino]propanamide Openeye Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[[(2S)-2-methylcyclohexylidene]amino]propanamide CAS Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[[(2S)-2-methylcyclohexylidene]amino]propanamide IUPAC Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[[(2S)-2-methylcyclohexylidene]amino]propanamide Traditional Name: (2S)-2-(1,3-benzothiazol-2-ylamino)-N-[[(2S)-2-methylcyclohexylidene]amino]propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1=NNC(=O)C(C)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H]1CCCCC1=NNC(=O)[C@H](C)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H22N4OS/c1-11-7-3-4-8-13(11)20-21-16(22)12(2)18-17-19-14-9-5-6-10-15(14)23-17/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,18,19)(H,21,22)/t11-,12-/m0/s1