N-[2-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]cyclohexanecarboxamide

Systemtic Name: N-[2-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]cyclohexanecarboxamide Openeye Name: N-[2-[2-(allylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]cyclohexanecarboxamide CAS Name: N-[2-[[2-oxo-2-(prop-2-enylamino)ethyl]thio]-4-phenyl-5-thiazolyl]cyclohexanecarboxamide IUPAC Name: N-[2-[2-oxo-2-(prop-2-enylamino)ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]cyclohexanecarboxamide Traditional Name: N-[2-[[2-(allylamino)-2-keto-ethyl]thio]-4-phenyl-thiazol-5-yl]cyclohexanecarboxamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CSC1=NC(=C(S1)NC(=O)C2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)CSC1=NC(=C(S1)NC(=O)C2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2S2/c1-2-13-22-17(25)14-27-21-23-18(15-9-5-3-6-10-15)20(28-21)24-19(26)16-11-7-4-8-12-16/h2-3,5-6,9-10,16H,1,4,7-8,11-14H2,(H,22,25)(H,24,26)