N-[4,7-bis(chloranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[4,7-bis(chloranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(4,7-dichloro-3-propargyl-1,3-benzothiazol-2-ylidene)-1-isopropyl-pyrazole-3-carboxamide Formula: C17H14Cl2N4OS MolecularWeight: 393.29026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CC(=N1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)Cl)CC#C

Isomeric SMILES

CC(C)N1C=CC(=N1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)Cl)CC#C

InChI

InChI=1S/C17H14Cl2N4OS/c1-4-8-22-14-11(18)5-6-12(19)15(14)25-17(22)20-16(24)13-7-9-23(21-13)10(2)3/h1,5-7,9-10H,8H2,2-3H3