N-[(E)-(3,5-dimethyl-1-pentyl-pyrazol-4-yl)methylideneamino]-1,3-benzothiazol-2-amine

Systemtic Name: N-[(E)-(3,5-dimethyl-1-pentyl-pyrazol-4-yl)methylideneamino]-1,3-benzothiazol-2-amine Openeye Name: N-[(E)-(3,5-dimethyl-1-pentyl-pyrazol-4-yl)methyleneamino]-1,3-benzothiazol-2-amine CAS Name: N-[(E)-(3,5-dimethyl-1-pentyl-4-pyrazolyl)methylideneamino]-1,3-benzothiazol-2-amine IUPAC Name: N-[(E)-(3,5-dimethyl-1-pentylpyrazol-4-yl)methylideneamino]-1,3-benzothiazol-2-amine Traditional Name: [(E)-(1-amyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]-(1,3-benzothiazol-2-yl)amine Formula: C18H23N5S MolecularWeight: 341.47372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C(=N1)C)C=NNC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CCCCCN1C(=C(C(=N1)C)/C=N/NC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H23N5S/c1-4-5-8-11-23-14(3)15(13(2)22-23)12-19-21-18-20-16-9-6-7-10-17(16)24-18/h6-7,9-10,12H,4-5,8,11H2,1-3H3,(H,20,21)/b19-12+