S-(1,3-benzothiazol-2-yl) (E)-3-(3-nitrophenyl)prop-2-enethioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) (E)-3-(3-nitrophenyl)prop-2-enethioate Openeye Name: S-(1,3-benzothiazol-2-yl) (E)-3-(3-nitrophenyl)prop-2-enethioate CAS Name: (E)-3-(3-nitrophenyl)-2-propenethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) (E)-3-(3-nitrophenyl)prop-2-enethioate Traditional Name: (E)-3-(3-nitrophenyl)prop-2-enethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C16H10N2O3S2 MolecularWeight: 342.3922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O3S2/c19-15(9-8-11-4-3-5-12(10-11)18(20)21)23-16-17-13-6-1-2-7-14(13)22-16/h1-10H/b9-8+