N-(cyanomethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(cyanomethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(cyanomethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(cyanomethyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(cyanomethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(cyanomethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C14H10N4OS MolecularWeight: 282.3204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC#N

Isomeric SMILES

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC#N

InChI

InChI=1S/C14H10N4OS/c15-5-6-16-13(19)10-3-4-11-12(9-10)20-14(17-11)18-7-1-2-8-18/h1-4,7-9H,6H2,(H,16,19)