tert-butyl N-[1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)-1-thiophen-2-yl-ethyl]carbamate

Systemtic Name: tert-butyl N-[1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)-1-thiophen-2-yl-ethyl]carbamate Openeye Name: tert-butyl N-[1-(2-methyl-3-thioxo-4H-1,4-benzoxazin-6-yl)-1-(2-thienyl)ethyl]carbamate CAS Name: N-[1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)-1-thiophen-2-ylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)-1-thiophen-2-ylethyl]carbamate Traditional Name: N-[1-(2-methyl-3-thioxo-4H-1,4-benzoxazin-6-yl)-1-(2-thienyl)ethyl]carbamic acid tert-butyl ester Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)NC2=C(O1)C=CC(=C2)C(C)(C3=CC=CS3)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1C(=S)NC2=C(O1)C=CC(=C2)C(C)(C3=CC=CS3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H24N2O3S2/c1-12-17(26)21-14-11-13(8-9-15(14)24-12)20(5,16-7-6-10-27-16)22-18(23)25-19(2,3)4/h6-12H,1-5H3,(H,21,26)(H,22,23)