N-[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-3-phenoxy-propanamide

Systemtic Name: N-[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-3-phenoxy-propanamide Openeye Name: N-[(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-3-phenoxy-propanamide CAS Name: N-[(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidinyl]-3-phenoxypropanamide IUPAC Name: N-[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-3-phenoxypropanamide Traditional Name: N-[(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-3-phenoxy-propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)NC(=O)CCOC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC3=CC=CC=C3S2)NC(=O)CCOC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S/c25-20(12-14-26-17-8-2-1-3-9-17)22-16-7-6-13-24(15-16)21-23-18-10-4-5-11-19(18)27-21/h1-5,8-11,16H,6-7,12-15H2,(H,22,25)/t16-/m0/s1