N-[(3-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[(3-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[(3-phenylphenyl)methyl]-N-(3-pyridylmethyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[(3-phenylphenyl)methyl]-N-(3-pyridinylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[(3-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(3-phenylbenzyl)-N-(3-pyridylmethyl)-1,3-benzothiazole-6-carboxamide Formula: C27H21N3OS MolecularWeight: 435.54014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC=C2)CN(CC3=CN=CC=C3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC=C2)CN(CC3=CN=CC=C3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C27H21N3OS/c31-27(24-11-12-25-26(15-24)32-19-29-25)30(18-21-7-5-13-28-16-21)17-20-6-4-10-23(14-20)22-8-2-1-3-9-22/h1-16,19H,17-18H2