(2S)-N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide Openeye Name: (2S)-N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide CAS Name: (2S)-N-[2-(1-cyclohexenyl)ethyl]-2-[(2-methyl-4-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanylpropanamide Traditional Name: (2S)-N-[2-(cyclohexen-1-yl)ethyl]-2-[(2-methylquinazolin-4-yl)thio]propionamide Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SC(C)C(=O)NCCC3=CCCCC3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)S[C@@H](C)C(=O)NCCC3=CCCCC3

InChI

InChI=1S/C20H25N3OS/c1-14(19(24)21-13-12-16-8-4-3-5-9-16)25-20-17-10-6-7-11-18(17)22-15(2)23-20/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3,(H,21,24)/t14-/m0/s1