1,4-dimethyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide

Systemtic Name: 1,4-dimethyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide Openeye Name: 1,4-dimethyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide CAS Name: 1,4-dimethyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-pyrazolecarboxamide IUPAC Name: 1,4-dimethyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide Traditional Name: 1,4-dimethyl-N-(3-propargyl-1,3-benzothiazol-2-ylidene)pyrazole-3-carboxamide Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1C(=O)N=C2N(C3=CC=CC=C3S2)CC#C)C

Isomeric SMILES

CC1=CN(N=C1C(=O)N=C2N(C3=CC=CC=C3S2)CC#C)C

InChI

InChI=1S/C16H14N4OS/c1-4-9-20-12-7-5-6-8-13(12)22-16(20)17-15(21)14-11(2)10-19(3)18-14/h1,5-8,10H,9H2,2-3H3