N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-bromanyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-bromanyl-1H-pyrrole-2-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-bromo-1H-pyrrole-2-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-bromo-1H-pyrrole-2-carboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-bromo-1H-pyrrole-2-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-bromo-1H-pyrrole-2-carboxamide Formula: C19H14BrN3OS MolecularWeight: 412.30296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CC3=CC=C(C=C3)NC(=O)C4=CC(=CN4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CC3=CC=C(C=C3)NC(=O)C4=CC(=CN4)Br

InChI

InChI=1S/C19H14BrN3OS/c20-13-10-16(21-11-13)19(24)22-14-7-5-12(6-8-14)9-18-23-15-3-1-2-4-17(15)25-18/h1-8,10-11,21H,9H2,(H,22,24)