(2Z)-2-[2-(2-azanylethylamino)pyrimidin-4-yl]-2-(3H-1,3-benzothiazol-2-ylidene)ethanenitrile

Systemtic Name: (2Z)-2-[2-(2-azanylethylamino)pyrimidin-4-yl]-2-(3H-1,3-benzothiazol-2-ylidene)ethanenitrile Openeye Name: (2Z)-2-[2-(2-aminoethylamino)pyrimidin-4-yl]-2-(3H-1,3-benzothiazol-2-ylidene)acetonitrile CAS Name: (2Z)-2-[2-(2-aminoethylamino)-4-pyrimidinyl]-2-(3H-1,3-benzothiazol-2-ylidene)acetonitrile IUPAC Name: (2Z)-2-[2-(2-aminoethylamino)pyrimidin-4-yl]-2-(3H-1,3-benzothiazol-2-ylidene)acetonitrile Traditional Name: (2Z)-2-[2-(2-aminoethylamino)pyrimidin-4-yl]-2-(3H-1,3-benzothiazol-2-ylidene)acetonitrile Formula: C15H14N6S MolecularWeight: 310.37686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C3=NC(=NC=C3)NCCN)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(/C#N)\C3=NC(=NC=C3)NCCN)/S2

InChI

InChI=1S/C15H14N6S/c16-6-8-19-15-18-7-5-11(21-15)10(9-17)14-20-12-3-1-2-4-13(12)22-14/h1-5,7,20H,6,8,16H2,(H,18,19,21)/b14-10+