N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C2=CC3=C(C=C2)OC(=N3)CCCC4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)C2=CC3=C(C=C2)OC(=N3)CCCC4=CC=CC=C4

InChI

InChI=1S/C21H22N2O4S/c24-21(22-17-11-12-28(25,26)14-17)16-9-10-19-18(13-16)23-20(27-19)8-4-7-15-5-2-1-3-6-15/h1-3,5-6,9-10,13,17H,4,7-8,11-12,14H2,(H,22,24)