N-butyl-5-(quinolin-8-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-butyl-5-(quinolin-8-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-butyl-5-(8-quinolylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: N-butyl-5-(8-quinolinylmethylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: N-butyl-5-(quinolin-8-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: butyl-[5-(8-quinolylmethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C16H18N4S2 MolecularWeight: 330.47092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SCC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CCCCNC1=NN=C(S1)SCC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C16H18N4S2/c1-2-3-9-18-15-19-20-16(22-15)21-11-13-7-4-6-12-8-5-10-17-14(12)13/h4-8,10H,2-3,9,11H2,1H3,(H,18,19)