N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-1,3-benzothiazole-2-carboxamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-1,3-benzothiazole-2-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[2-(1-pyrazolyl)ethyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-1,3-benzothiazole-2-carboxamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-1,3-benzothiazole-2-carboxamide Formula: C20H14ClN5OS2 MolecularWeight: 439.94106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(S4)C=CC=C5Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(S4)C=CC=C5Cl

InChI

InChI=1S/C20H14ClN5OS2/c21-13-5-3-8-16-17(13)24-20(29-16)26(12-11-25-10-4-9-22-25)19(27)18-23-14-6-1-2-7-15(14)28-18/h1-10H,11-12H2