N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-1,2-thiazol-5-yl]amino]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-1,2-thiazol-5-yl]amino]pentanamide Openeye Name: N-(cyanomethyl)-2-[[4-[4-(4-isopropylpiperazin-1-yl)phenyl]-3-methyl-isothiazol-5-yl]amino]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-[4-(4-propan-2-yl-1-piperazinyl)phenyl]-5-isothiazolyl]amino]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-1,2-thiazol-5-yl]amino]pentanamide Traditional Name: N-(cyanomethyl)-2-[[4-[4-(4-isopropylpiperazino)phenyl]-3-methyl-isothiazol-5-yl]amino]-4-methyl-valeramide Formula: C25H36N6OS MolecularWeight: 468.65794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C2=CC=C(C=C2)N3CCN(CC3)C(C)C)NC(CC(C)C)C(=O)NCC#N

Isomeric SMILES

CC1=NSC(=C1C2=CC=C(C=C2)N3CCN(CC3)C(C)C)NC(CC(C)C)C(=O)NCC#N

InChI

InChI=1S/C25H36N6OS/c1-17(2)16-22(24(32)27-11-10-26)28-25-23(19(5)29-33-25)20-6-8-21(9-7-20)31-14-12-30(13-15-31)18(3)4/h6-9,17-18,22,28H,11-16H2,1-5H3,(H,27,32)