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

Systemtic Name: N-[2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-3-methoxy-benzamide Openeye Name: N-[2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]-3-methoxy-benzamide CAS Name: N-[2-[[2-(cyclopropylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]-3-methoxybenzamide IUPAC Name: N-[2-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-3-methoxybenzamide Traditional Name: N-[2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-4-phenyl-thiazol-5-yl]-3-methoxy-benzamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=C(N=C(S2)SCC(=O)NC3CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=C(N=C(S2)SCC(=O)NC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S2/c1-28-17-9-5-8-15(12-17)20(27)25-21-19(14-6-3-2-4-7-14)24-22(30-21)29-13-18(26)23-16-10-11-16/h2-9,12,16H,10-11,13H2,1H3,(H,23,26)(H,25,27)