N-(3-piperidin-1-ium-1-ylpropyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-(3-piperidin-1-ium-1-ylpropyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-(3-piperidin-1-ium-1-ylpropyl)-3-(2-thioxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[3-(1-piperidin-1-iumyl)propyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-(3-piperidin-1-ium-1-ylpropyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(3-piperidin-1-ium-1-ylpropyl)-3-(2-thioxo-1,3-benzoxazol-3-yl)propionamide Formula: C18H26N3O2S+ MolecularWeight: 348.48294

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)CCN2C3=CC=CC=C3OC2=S

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)CCN2C3=CC=CC=C3OC2=S

InChI

InChI=1S/C18H25N3O2S/c22-17(19-10-6-13-20-11-4-1-5-12-20)9-14-21-15-7-2-3-8-16(15)23-18(21)24/h2-3,7-8H,1,4-6,9-14H2,(H,19,22)/p+1