N-cycloheptyl-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cycloheptyl-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-cycloheptyl-2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-cycloheptyl-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cycloheptyl-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-cycloheptyl-2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SC2=NN=C(N2CCOC)C3=CC=NC=C3

Isomeric SMILES

CC(C(=O)NC1CCCCCC1)SC2=NN=C(N2CCOC)C3=CC=NC=C3

InChI

InChI=1S/C20H29N5O2S/c1-15(19(26)22-17-7-5-3-4-6-8-17)28-20-24-23-18(25(20)13-14-27-2)16-9-11-21-12-10-16/h9-12,15,17H,3-8,13-14H2,1-2H3,(H,22,26)