2-(3-phenylpropyl)-N-[(1S)-1-(1,3-thiazol-2-yl)ethyl]-1,3-benzoxazole-5-carboxamide

Systemtic Name: 2-(3-phenylpropyl)-N-[(1S)-1-(1,3-thiazol-2-yl)ethyl]-1,3-benzoxazole-5-carboxamide Openeye Name: 2-(3-phenylpropyl)-N-[(1S)-1-thiazol-2-ylethyl]-1,3-benzoxazole-5-carboxamide CAS Name: 2-(3-phenylpropyl)-N-[(1S)-1-(2-thiazolyl)ethyl]-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-(3-phenylpropyl)-N-[(1S)-1-(1,3-thiazol-2-yl)ethyl]-1,3-benzoxazole-5-carboxamide Traditional Name: 2-(3-phenylpropyl)-N-[(1S)-1-thiazol-2-ylethyl]-1,3-benzoxazole-5-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CS1)NC(=O)C2=CC3=C(C=C2)OC(=N3)CCCC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=NC=CS1)NC(=O)C2=CC3=C(C=C2)OC(=N3)CCCC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S/c1-15(22-23-12-13-28-22)24-21(26)17-10-11-19-18(14-17)25-20(27-19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-15H,5,8-9H2,1H3,(H,24,26)/t15-/m0/s1