N-(cyclopentylcarbamoyl)-3-[[4-(2-propan-2-ylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(cyclopentylcarbamoyl)-3-[[4-(2-propan-2-ylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(cyclopentylcarbamoyl)-3-[[4-(2-isopropylphenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-3-[[4-(2-propan-2-ylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(cyclopentylcarbamoyl)-3-[[4-(2-propan-2-ylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(cyclopentylcarbamoyl)-3-[[4-o-cumenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C25H30N6O2S MolecularWeight: 478.6097

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=NN=C2SCCC(=O)NC(=O)NC3CCCC3)C4=CN=CC=C4

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=NN=C2SCCC(=O)NC(=O)NC3CCCC3)C4=CN=CC=C4

InChI

InChI=1S/C25H30N6O2S/c1-17(2)20-11-5-6-12-21(20)31-23(18-8-7-14-26-16-18)29-30-25(31)34-15-13-22(32)28-24(33)27-19-9-3-4-10-19/h5-8,11-12,14,16-17,19H,3-4,9-10,13,15H2,1-2H3,(H2,27,28,32,33)