(2R)-4-[3-(dimethylamino)propylcarbamothioyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-[3-(dimethylamino)propylcarbamothioyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-[3-(dimethylamino)propylcarbamothioyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[[3-(dimethylamino)propylamino]-sulfanylidenemethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-[3-(dimethylamino)propylcarbamothioyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-[3-(dimethylamino)propylthiocarbamoyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C18H28N4O2S MolecularWeight: 364.50552

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(=S)NCCCN(C)C

Isomeric SMILES

CCCNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=S)NCCCN(C)C

InChI

InChI=1S/C18H28N4O2S/c1-4-10-19-17(23)16-13-22(14-8-5-6-9-15(14)24-16)18(25)20-11-7-12-21(2)3/h5-6,8-9,16H,4,7,10-13H2,1-3H3,(H,19,23)(H,20,25)/t16-/m1/s1