methyl 2-(2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: methyl 2-(2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: methyl 2-(2-isopropyl-3-thioxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetic acid methyl ester IUPAC Name: methyl 2-(2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(2-isopropyl-3-thioxo-1,4-benzoxazin-4-yl)acetic acid methyl ester Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=S)N(C2=CC=CC=C2O1)CC(=O)OC

Isomeric SMILES

CC(C)C1C(=S)N(C2=CC=CC=C2O1)CC(=O)OC

InChI

InChI=1S/C14H17NO3S/c1-9(2)13-14(19)15(8-12(16)17-3)10-6-4-5-7-11(10)18-13/h4-7,9,13H,8H2,1-3H3