2-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[(1-phenyl-4-pyrazolyl)methylthio]-1,3-benzothiazole IUPAC Name: 2-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[(1-phenylpyrazol-4-yl)methylthio]-1,3-benzothiazole Formula: C17H13N3S2 MolecularWeight: 323.43522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3S2/c1-2-6-14(7-3-1)20-11-13(10-18-20)12-21-17-19-15-8-4-5-9-16(15)22-17/h1-11H,12H2