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

Systemtic Name: 2-azanyl-6-[(R)-1,3-benzothiazol-2-yl(cyano)methyl]-5-cyano-3,4-dihydropyridine-3-carboxamide Openeye Name: 2-amino-6-[(R)-1,3-benzothiazol-2-yl(cyano)methyl]-5-cyano-3,4-dihydropyridine-3-carboxamide CAS Name: 2-amino-6-[(R)-1,3-benzothiazol-2-yl(cyano)methyl]-5-cyano-3,4-dihydropyridine-3-carboxamide IUPAC Name: 2-amino-6-[(R)-1,3-benzothiazol-2-yl(cyano)methyl]-5-cyano-3,4-dihydropyridine-3-carboxamide Traditional Name: 2-amino-6-[(R)-1,3-benzothiazol-2-yl(cyano)methyl]-5-cyano-3,4-dihydropyridine-3-carboxamide Formula: C16H12N6OS MolecularWeight: 336.37108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C(C(=NC(=C1C#N)[C@H](C#N)C2=NC3=CC=CC=C3S2)N)C(=O)N

InChI

InChI=1S/C16H12N6OS/c17-6-8-5-9(15(20)23)14(19)22-13(8)10(7-18)16-21-11-3-1-2-4-12(11)24-16/h1-4,9-10H,5H2,(H2,19,22)(H2,20,23)/t9?,10-/m0/s1