2-[[1-(4-ethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinoxalin-6-yl-propanamide

Systemtic Name: 2-[[1-(4-ethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinoxalin-6-yl-propanamide Openeye Name: 2-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanyl-N-quinoxalin-6-yl-propanamide CAS Name: 2-[[1-(4-ethylphenyl)-5-tetrazolyl]thio]-N-(6-quinoxalinyl)propanamide IUPAC Name: 2-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanyl-N-quinoxalin-6-ylpropanamide Traditional Name: 2-[[1-(4-ethylphenyl)tetrazol-5-yl]thio]-N-quinoxalin-6-yl-propionamide Formula: C20H19N7OS MolecularWeight: 405.47616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=NN=N2)SC(C)C(=O)NC3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=NN=N2)SC(C)C(=O)NC3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C20H19N7OS/c1-3-14-4-7-16(8-5-14)27-20(24-25-26-27)29-13(2)19(28)23-15-6-9-17-18(12-15)22-11-10-21-17/h4-13H,3H2,1-2H3,(H,23,28)