(2S)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-butanamide

Systemtic Name: (2S)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-butanamide Openeye Name: (2S)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-butanamide CAS Name: (2S)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-phenoxybutanamide IUPAC Name: (2S)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-phenoxybutanamide Traditional Name: (2S)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-butyramide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)C2=CC(=C(C=C2)OC)OC)OC3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)NC1=NN=C(S1)C2=CC(=C(C=C2)OC)OC)OC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S/c1-4-15(27-14-8-6-5-7-9-14)18(24)21-20-23-22-19(28-20)13-10-11-16(25-2)17(12-13)26-3/h5-12,15H,4H2,1-3H3,(H,21,23,24)/t15-/m0/s1