3,5-diacetamido-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]benzamide

Systemtic Name: 3,5-diacetamido-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]benzamide Openeye Name: 3,5-diacetamido-N-[(4S)-thiochroman-4-yl]benzamide CAS Name: 3,5-diacetamido-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]benzamide IUPAC Name: 3,5-diacetamido-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]benzamide Traditional Name: 3,5-diacetamido-N-[(4S)-thiochroman-4-yl]benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NC2CCSC3=CC=CC=C23)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)N[C@H]2CCSC3=CC=CC=C23)NC(=O)C

InChI

InChI=1S/C20H21N3O3S/c1-12(24)21-15-9-14(10-16(11-15)22-13(2)25)20(26)23-18-7-8-27-19-6-4-3-5-17(18)19/h3-6,9-11,18H,7-8H2,1-2H3,(H,21,24)(H,22,25)(H,23,26)/t18-/m0/s1