1-[(6-chloranyl-2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(6-chloranyl-2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(6-chloro-2-thioxo-1,3-benzoxazol-3-yl)methyl]piperidine-4-carboxamide CAS Name: 1-[(6-chloro-2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(6-chloro-2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-[(6-chloro-2-thioxo-1,3-benzoxazol-3-yl)methyl]isonipecotamide Formula: C14H16ClN3O2S MolecularWeight: 325.81374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CN2C3=C(C=C(C=C3)Cl)OC2=S

Isomeric SMILES

C1CN(CCC1C(=O)N)CN2C3=C(C=C(C=C3)Cl)OC2=S

InChI

InChI=1S/C14H16ClN3O2S/c15-10-1-2-11-12(7-10)20-14(21)18(11)8-17-5-3-9(4-6-17)13(16)19/h1-2,7,9H,3-6,8H2,(H2,16,19)