(E)-2-(1,3-benzothiazol-2-yl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[5-(3-nitrophenyl)-2-thienyl]prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[5-(3-nitrophenyl)-2-thiophenyl]-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[5-(3-nitrophenyl)-2-thienyl]acrylonitrile Formula: C20H11N3O2S2 MolecularWeight: 389.45024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=C(S3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=C/C3=CC=C(S3)C4=CC(=CC=C4)[N+](=O)[O-])/C#N

InChI

InChI=1S/C20H11N3O2S2/c21-12-14(20-22-17-6-1-2-7-19(17)27-20)11-16-8-9-18(26-16)13-4-3-5-15(10-13)23(24)25/h1-11H/b14-11+