4-butoxy-N-[2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide Openeye Name: 4-butoxy-N-[2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]benzamide CAS Name: 4-butoxy-N-[2-[[2-(cyclopropylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]benzamide IUPAC Name: 4-butoxy-N-[2-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide Traditional Name: 4-butoxy-N-[2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-4-phenyl-thiazol-5-yl]benzamide Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)SCC(=O)NC3CC3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)SCC(=O)NC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3S2/c1-2-3-15-31-20-13-9-18(10-14-20)23(30)28-24-22(17-7-5-4-6-8-17)27-25(33-24)32-16-21(29)26-19-11-12-19/h4-10,13-14,19H,2-3,11-12,15-16H2,1H3,(H,26,29)(H,28,30)