(2S)-2-morpholin-4-ylcarbonyl-N-(phenylmethyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide

Systemtic Name: (2S)-2-morpholin-4-ylcarbonyl-N-(phenylmethyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Openeye Name: (2S)-N-benzyl-2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide CAS Name: (2S)-2-[4-morpholinyl(oxo)methyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide IUPAC Name: (2S)-N-benzyl-2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Traditional Name: (2S)-N-benzyl-2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2CN(C3=CC=CC=C3O2)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S/c25-20(23-10-12-26-13-11-23)19-15-24(17-8-4-5-9-18(17)27-19)21(28)22-14-16-6-2-1-3-7-16/h1-9,19H,10-15H2,(H,22,28)/t19-/m0/s1