2-azanyl-6-[1,3-benzothiazol-2-yl(cyano)methyl]-1,4-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[1,3-benzothiazol-2-yl(cyano)methyl]-1,4-dihydropyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[1,3-benzothiazol-2-yl(cyano)methyl]-1,4-dihydropyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[1,3-benzothiazol-2-yl(cyano)methyl]-1,4-dihydropyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[1,3-benzothiazol-2-yl(cyano)methyl]-1,4-dihydropyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[1,3-benzothiazol-2-yl(cyano)methyl]-1,4-dihydropyridine-3,5-dicarbonitrile Formula: C16H10N6S MolecularWeight: 318.3558

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(NC(=C1C#N)N)C(C#N)C2=NC3=CC=CC=C3S2)C#N

Isomeric SMILES

C1C(=C(NC(=C1C#N)N)C(C#N)C2=NC3=CC=CC=C3S2)C#N

InChI

InChI=1S/C16H10N6S/c17-6-9-5-10(7-18)15(20)22-14(9)11(8-19)16-21-12-3-1-2-4-13(12)23-16/h1-4,11,22H,5,20H2