(4E)-4-[(3-phenyl-2H-1,3-benzothiazol-2-yl)methylidene]-N-propyl-pyrimidin-1-amine

Systemtic Name: (4E)-4-[(3-phenyl-2H-1,3-benzothiazol-2-yl)methylidene]-N-propyl-pyrimidin-1-amine Openeye Name: (4E)-4-[(3-phenyl-2H-1,3-benzothiazol-2-yl)methylene]-N-propyl-pyrimidin-1-amine CAS Name: (4E)-4-[(3-phenyl-2H-1,3-benzothiazol-2-yl)methylidene]-N-propyl-1-pyrimidinamine IUPAC Name: (4E)-4-[(3-phenyl-2H-1,3-benzothiazol-2-yl)methylidene]-N-propylpyrimidin-1-amine Traditional Name: [(4E)-4-[(3-phenyl-2H-1,3-benzothiazol-2-yl)methylene]pyrimidin-1-yl]-propyl-amine Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CCCNN1C=CC(=CC2N(C3=CC=CC=C3S2)C4=CC=CC=C4)N=C1

Isomeric SMILES

CCCNN1C=C/C(=C\C2N(C3=CC=CC=C3S2)C4=CC=CC=C4)/N=C1

InChI

InChI=1S/C21H22N4S/c1-2-13-23-24-14-12-17(22-16-24)15-21-25(18-8-4-3-5-9-18)19-10-6-7-11-20(19)26-21/h3-12,14-16,21,23H,2,13H2,1H3/b17-15+