(2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(thiophen-2-ylmethyl)propanamide Openeye Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(2-thienylmethyl)propanamide CAS Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(thiophen-2-ylmethyl)propanamide Traditional Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(2-thenyl)propionamide Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CS1)OC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N2O2S2/c1-14(20(24)22-13-17-5-4-12-26-17)25-16-10-8-15(9-11-16)21-23-18-6-2-3-7-19(18)27-21/h2-12,14H,13H2,1H3,(H,22,24)/t14-/m0/s1