N-[1-[(1-cyanocyclopropyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-[2-(piperidin-4-ylamino)-1,3-thiazol-4-yl]benzamide

Systemtic Name: N-[1-[(1-cyanocyclopropyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-[2-(piperidin-4-ylamino)-1,3-thiazol-4-yl]benzamide Openeye Name: N-[1-[(1-cyanocyclopropyl)carbamoyl]-3-methyl-butyl]-4-[2-(4-piperidylamino)thiazol-4-yl]benzamide CAS Name: N-[1-[(1-cyanocyclopropyl)amino]-4-methyl-1-oxopentan-2-yl]-4-[2-(4-piperidinylamino)-4-thiazolyl]benzamide IUPAC Name: N-[1-[(1-cyanocyclopropyl)amino]-4-methyl-1-oxopentan-2-yl]-4-[2-(piperidin-4-ylamino)-1,3-thiazol-4-yl]benzamide Traditional Name: N-[1-[(1-cyanocyclopropyl)carbamoyl]-3-methyl-butyl]-4-[2-(4-piperidylamino)thiazol-4-yl]benzamide Formula: C25H32N6O2S MolecularWeight: 480.62558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1(CC1)C#N)NC(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC4CCNCC4

Isomeric SMILES

CC(C)CC(C(=O)NC1(CC1)C#N)NC(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC4CCNCC4

InChI

InChI=1S/C25H32N6O2S/c1-16(2)13-20(23(33)31-25(15-26)9-10-25)29-22(32)18-5-3-17(4-6-18)21-14-34-24(30-21)28-19-7-11-27-12-8-19/h3-6,14,16,19-20,27H,7-13H2,1-2H3,(H,28,30)(H,29,32)(H,31,33)