ethyl 4-[[2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazol-4-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazol-4-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]thiazole-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-4-thiazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]thiazole-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CSC(=N2)CSC3=NC4=C(C=CC=C4O3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CSC(=N2)CSC3=NC4=C(C=CC=C4O3)C

InChI

InChI=1S/C20H22N4O4S2/c1-3-27-20(26)24-9-7-23(8-10-24)18(25)14-11-29-16(21-14)12-30-19-22-17-13(2)5-4-6-15(17)28-19/h4-6,11H,3,7-10,12H2,1-2H3