N-[(2R)-4-[[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]amino]-4-oxidanylidene-1-phenyl-butan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(2R)-4-[[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]amino]-4-oxidanylidene-1-phenyl-butan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1R)-3-[4-(2-aminothiazol-4-yl)anilino]-1-benzyl-3-oxo-propyl]cyclohexanecarboxamide CAS Name: N-[(2R)-4-[4-(2-amino-4-thiazolyl)anilino]-4-oxo-1-phenylbutan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(2R)-4-[4-(2-amino-1,3-thiazol-4-yl)anilino]-4-oxo-1-phenylbutan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1R)-3-[4-(2-aminothiazol-4-yl)anilino]-1-benzyl-3-keto-propyl]cyclohexanecarboxamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)C4=CSC(=N4)N

Isomeric SMILES

C1CCC(CC1)C(=O)N[C@H](CC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)C4=CSC(=N4)N

InChI

InChI=1S/C26H30N4O2S/c27-26-30-23(17-33-26)19-11-13-21(14-12-19)28-24(31)16-22(15-18-7-3-1-4-8-18)29-25(32)20-9-5-2-6-10-20/h1,3-4,7-8,11-14,17,20,22H,2,5-6,9-10,15-16H2,(H2,27,30)(H,28,31)(H,29,32)/t22-/m1/s1