2-quinazolin-4-ylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-quinazolin-4-ylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-quinazolin-4-ylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-(4-quinazolinylthio)-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-quinazolin-4-ylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-(quinazolin-4-ylthio)-N-(3,4,5-trimethoxybenzyl)acetamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C20H21N3O4S/c1-25-16-8-13(9-17(26-2)19(16)27-3)10-21-18(24)11-28-20-14-6-4-5-7-15(14)22-12-23-20/h4-9,12H,10-11H2,1-3H3,(H,21,24)