2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-propan-2-ylphenyl)butanamide

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-propan-2-ylphenyl)butanamide Openeye Name: N-(4-isopropylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-butanamide CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]-N-(4-propan-2-ylphenyl)butanamide IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(4-propan-2-ylphenyl)butanamide Traditional Name: N-p-cumenyl-2-[(1-phenyltetrazol-5-yl)thio]butyramide Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(C)C)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(C)C)SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C20H23N5OS/c1-4-18(19(26)21-16-12-10-15(11-13-16)14(2)3)27-20-22-23-24-25(20)17-8-6-5-7-9-17/h5-14,18H,4H2,1-3H3,(H,21,26)