2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[(4-methylphenyl)carbamoyl]propanamide

Systemtic Name: 2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[(4-methylphenyl)carbamoyl]propanamide Openeye Name: 2-(1-cyclohexyltetrazol-5-yl)sulfanyl-N-(p-tolylcarbamoyl)propanamide CAS Name: 2-[(1-cyclohexyl-5-tetrazolyl)thio]-N-[(4-methylanilino)-oxomethyl]propanamide IUPAC Name: 2-(1-cyclohexyltetrazol-5-yl)sulfanyl-N-[(4-methylphenyl)carbamoyl]propanamide Traditional Name: 2-[(1-cyclohexyltetrazol-5-yl)thio]-N-(p-tolylcarbamoyl)propionamide Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=O)C(C)SC2=NN=NN2C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC(=O)C(C)SC2=NN=NN2C3CCCCC3

InChI

InChI=1S/C18H24N6O2S/c1-12-8-10-14(11-9-12)19-17(26)20-16(25)13(2)27-18-21-22-23-24(18)15-6-4-3-5-7-15/h8-11,13,15H,3-7H2,1-2H3,(H2,19,20,25,26)