N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide

Systemtic Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Openeye Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide CAS Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide IUPAC Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide Traditional Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N2CC=C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N2CC=C

InChI

InChI=1S/C19H17N3O3S/c1-4-8-21-16-9-12(2)13(3)10-17(16)26-19(21)20-18(23)14-6-5-7-15(11-14)22(24)25/h4-7,9-11H,1,8H2,2-3H3