S-(6-ethoxy-1,3-benzothiazol-2-yl) 3-(4-nitrophenyl)prop-2-enethioate

Systemtic Name: S-(6-ethoxy-1,3-benzothiazol-2-yl) 3-(4-nitrophenyl)prop-2-enethioate Openeye Name: S-(6-ethoxy-1,3-benzothiazol-2-yl) 3-(4-nitrophenyl)prop-2-enethioate CAS Name: 3-(4-nitrophenyl)-2-propenethioic acid S-(6-ethoxy-1,3-benzothiazol-2-yl) ester IUPAC Name: S-(6-ethoxy-1,3-benzothiazol-2-yl) 3-(4-nitrophenyl)prop-2-enethioate Traditional Name: 3-(4-nitrophenyl)prop-2-enethioic acid S-(6-ethoxy-1,3-benzothiazol-2-yl) ester Formula: C18H14N2O4S2 MolecularWeight: 386.44476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O4S2/c1-2-24-14-8-9-15-16(11-14)25-18(19-15)26-17(21)10-5-12-3-6-13(7-4-12)20(22)23/h3-11H,2H2,1H3