N-(pyridin-4-ylmethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(pyridin-4-ylmethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(4-pyridylmethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(pyridin-4-ylmethyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(pyridin-4-ylmethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(4-pyridylmethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C18H14N4OS MolecularWeight: 334.39496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C18H14N4OS/c23-17(20-12-13-5-7-19-8-6-13)14-3-4-15-16(11-14)24-18(21-15)22-9-1-2-10-22/h1-11H,12H2,(H,20,23)