N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(quinazolin-4-ylthio)acetamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)CSC2=NC=NC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)CSC2=NC=NC3=CC=CC=C32)C

InChI

InChI=1S/C18H21N5OS/c1-13-10-14(2)23(22-13)9-5-8-19-17(24)11-25-18-15-6-3-4-7-16(15)20-12-21-18/h3-4,6-7,10,12H,5,8-9,11H2,1-2H3,(H,19,24)