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

Systemtic Name: N-[2-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]butanamide Openeye Name: N-[2-[2-(allylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]butanamide CAS Name: N-[2-[[2-oxo-2-(prop-2-enylamino)ethyl]thio]-4-phenyl-5-thiazolyl]butanamide IUPAC Name: N-[2-[2-oxo-2-(prop-2-enylamino)ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]butanamide Traditional Name: N-[2-[[2-(allylamino)-2-keto-ethyl]thio]-4-phenyl-thiazol-5-yl]butyramide Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(N=C(S1)SCC(=O)NCC=C)C2=CC=CC=C2

Isomeric SMILES

CCCC(=O)NC1=C(N=C(S1)SCC(=O)NCC=C)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O2S2/c1-3-8-14(22)20-17-16(13-9-6-5-7-10-13)21-18(25-17)24-12-15(23)19-11-4-2/h4-7,9-10H,2-3,8,11-12H2,1H3,(H,19,23)(H,20,22)