3-acetamido-N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(4-methoxyphenyl)propanamide

Systemtic Name: 3-acetamido-N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(4-methoxyphenyl)propanamide Openeye Name: 3-acetamido-3-(4-methoxyphenyl)-N-thiochroman-4-yl-propanamide CAS Name: 3-acetamido-N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(4-methoxyphenyl)propanamide IUPAC Name: 3-acetamido-N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(4-methoxyphenyl)propanamide Traditional Name: 3-acetamido-3-(4-methoxyphenyl)-N-thiochroman-4-yl-propionamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC1CCSC2=CC=CC=C12)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NC(CC(=O)NC1CCSC2=CC=CC=C12)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N2O3S/c1-14(24)22-19(15-7-9-16(26-2)10-8-15)13-21(25)23-18-11-12-27-20-6-4-3-5-17(18)20/h3-10,18-19H,11-13H2,1-2H3,(H,22,24)(H,23,25)