1,5-dimethyl-N-(5-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide

Systemtic Name: 1,5-dimethyl-N-(5-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide Openeye Name: N-(3-allyl-5-nitro-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: 1,5-dimethyl-N-(5-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-pyrazolecarboxamide IUPAC Name: 1,5-dimethyl-N-(5-nitro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide Traditional Name: N-(3-allyl-5-nitro-1,3-benzothiazol-2-ylidene)-1,5-dimethyl-pyrazole-3-carboxamide Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])CC=C

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])CC=C

InChI

InChI=1S/C16H15N5O3S/c1-4-7-20-13-9-11(21(23)24)5-6-14(13)25-16(20)17-15(22)12-8-10(2)19(3)18-12/h4-6,8-9H,1,7H2,2-3H3