2-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[(6-chlorothiochroman-4-yl)amino]-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[(6-chlorothiochroman-4-yl)amino]-N-(5-methylisoxazol-3-yl)propionamide Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)NC2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN3O2S/c1-9-7-15(20-22-9)19-16(21)10(2)18-13-5-6-23-14-4-3-11(17)8-12(13)14/h3-4,7-8,10,13,18H,5-6H2,1-2H3,(H,19,20,21)