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

Systemtic Name: (3R)-3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]amino]-N-(3-methoxyphenyl)butanamide Openeye Name: (3R)-N-(3-methoxyphenyl)-3-[[(4S)-thiochroman-4-yl]amino]butanamide CAS Name: (3R)-3-[[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]amino]-N-(3-methoxyphenyl)butanamide IUPAC Name: (3R)-3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]amino]-N-(3-methoxyphenyl)butanamide Traditional Name: (3R)-N-(3-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(=CC=C1)OC)NC2CCSC3=CC=CC=C23

Isomeric SMILES

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

InChI

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