N-(3-chloranyl-4-methyl-phenyl)-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-(1-phenyltetrazol-5-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-4-methylphenyl)-3-[(1-phenyl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-(1-phenyltetrazol-5-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-[(1-phenyltetrazol-5-yl)thio]propionamide Formula: C17H16ClN5OS MolecularWeight: 373.85984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCSC2=NN=NN2C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCSC2=NN=NN2C3=CC=CC=C3)Cl

InChI

InChI=1S/C17H16ClN5OS/c1-12-7-8-13(11-15(12)18)19-16(24)9-10-25-17-20-21-22-23(17)14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H,19,24)