(3R)-3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]amino]-N-(4-methoxyphenyl)butanamide

Systemtic Name: (3R)-3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]amino]-N-(4-methoxyphenyl)butanamide Openeye Name: (3R)-N-(4-methoxyphenyl)-3-[[(4S)-thiochroman-4-yl]amino]butanamide CAS Name: (3R)-3-[[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]amino]-N-(4-methoxyphenyl)butanamide IUPAC Name: (3R)-3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]amino]-N-(4-methoxyphenyl)butanamide Traditional Name: (3R)-N-(4-methoxyphenyl)-3-[[(4S)-thiochroman-4-yl]amino]butyramide Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O2S/c1-14(13-20(23)22-15-7-9-16(24-2)10-8-15)21-18-11-12-25-19-6-4-3-5-17(18)19/h3-10,14,18,21H,11-13H2,1-2H3,(H,22,23)/t14-,18+/m1/s1