tert-butyl 8-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]pyrazino[2,3-b][1,4]benzothiazine-10-carboxylate

Systemtic Name: tert-butyl 8-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]pyrazino[2,3-b][1,4]benzothiazine-10-carboxylate Openeye Name: tert-butyl 8-[(E)-3-ethoxy-3-oxo-prop-1-enyl]pyrazino[2,3-b][1,4]benzothiazine-10-carboxylate CAS Name: 8-[(E)-3-ethoxy-3-oxoprop-1-enyl]-10-pyrazino[2,3-b][1,4]benzothiazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-[(E)-3-ethoxy-3-oxoprop-1-enyl]pyrazino[2,3-b][1,4]benzothiazine-10-carboxylate Traditional Name: 8-[(E)-3-ethoxy-3-keto-prop-1-enyl]pyrazino[2,3-b][1,4]benzothiazine-10-carboxylic acid tert-butyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC2=C(C=C1)SC3=NC=CN=C3N2C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/C1=CC2=C(C=C1)SC3=NC=CN=C3N2C(=O)OC(C)(C)C

InChI

InChI=1S/C20H21N3O4S/c1-5-26-16(24)9-7-13-6-8-15-14(12-13)23(19(25)27-20(2,3)4)17-18(28-15)22-11-10-21-17/h6-12H,5H2,1-4H3/b9-7+