N-cyclopropyl-N-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: N-cyclopropyl-N-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-cyclopropyl-N-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-cyclopropyl-N-[4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-cyclopropyl-N-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-cyclopropyl-N-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]propionamide Formula: C19H26N5OS2+ MolecularWeight: 404.57264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC1)C2=NN(C(=S)S2)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)N(C1CC1)C2=NN(C(=S)S2)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H25N5OS2/c1-2-17(25)24(16-8-9-16)18-20-23(19(26)27-18)14-21-10-12-22(13-11-21)15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3/p+1