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

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-phenyl-1,3-thiazol-5-yl]-4-phenyl-butanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanyl-4-phenyl-thiazol-5-yl]-4-phenyl-butanamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]-4-phenyl-5-thiazolyl]-4-phenylbutanamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanyl-4-phenyl-1,3-thiazol-5-yl]-4-phenylbutanamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]-4-phenyl-thiazol-5-yl]-4-phenyl-butyramide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)NC2=C(N=C(S2)SCC(=O)N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)NC2=C(N=C(S2)SCC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S2/c22-17(25)14-27-21-24-19(16-11-5-2-6-12-16)20(28-21)23-18(26)13-7-10-15-8-3-1-4-9-15/h1-6,8-9,11-12H,7,10,13-14H2,(H2,22,25)(H,23,26)