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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CCC(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(=O)N(CCC(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N)CC4=CC=CC=C4

InChI

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