3-chloranyl-N-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]phenyl]benzamide

Systemtic Name: 3-chloranyl-N-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[(1-phenyltetrazol-5-yl)methylsulfanyl]phenyl]benzamide CAS Name: 3-chloro-N-[4-[(1-phenyl-5-tetrazolyl)methylthio]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[(1-phenyltetrazol-5-yl)methylsulfanyl]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[(1-phenyltetrazol-5-yl)methylthio]phenyl]benzamide Formula: C21H16ClN5OS MolecularWeight: 421.90264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)CSC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)CSC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H16ClN5OS/c22-16-6-4-5-15(13-16)21(28)23-17-9-11-19(12-10-17)29-14-20-24-25-26-27(20)18-7-2-1-3-8-18/h1-13H,14H2,(H,23,28)