(2S)-N-[3-(dimethylamino)propyl]-2-morpholin-4-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide

Systemtic Name: (2S)-N-[3-(dimethylamino)propyl]-2-morpholin-4-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Openeye Name: (2S)-N-[3-(dimethylamino)propyl]-2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide CAS Name: (2S)-N-[3-(dimethylamino)propyl]-2-[4-morpholinyl(oxo)methyl]-2,3-dihydro-1,4-benzoxazine-4-carbothioamide IUPAC Name: (2S)-N-[3-(dimethylamino)propyl]-2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Traditional Name: (2S)-N-[3-(dimethylamino)propyl]-2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)N1CC(OC2=CC=CC=C21)C(=O)N3CCOCC3

Isomeric SMILES

CN(C)CCCNC(=S)N1C[C@H](OC2=CC=CC=C21)C(=O)N3CCOCC3

InChI

InChI=1S/C19H28N4O3S/c1-21(2)9-5-8-20-19(27)23-14-17(18(24)22-10-12-25-13-11-22)26-16-7-4-3-6-15(16)23/h3-4,6-7,17H,5,8-14H2,1-2H3,(H,20,27)/t17-/m0/s1