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5-(1-phenyltetradecylamino)-1,2,3-thiadiazole-4-carboxylic acid

5-(1-phenyltetradecylamino)-1,2,3-thiadiazole-4-carboxylic acid

Systemtic Name:5-(1-phenyltetradecylamino)-1,2,3-thiadiazole-4-carboxylic acid
Openeye Name:5-(1-phenyltetradecylamino)thiadiazole-4-carboxylic acid
CAS Name:5-(1-phenyltetradecylamino)-4-thiadiazolecarboxylic acid
IUPAC Name:5-(1-phenyltetradecylamino)thiadiazole-4-carboxylic acid
Traditional Name:5-(1-phenyltetradecylamino)thiadiazole-4-carboxylic acid
Formula: C23H35N3O2S
MolecularWeight: 417.6079
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C1=CC=CC=C1)NC2=C(N=NS2)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCC(C1=CC=CC=C1)NC2=C(N=NS2)C(=O)O


InChI

InChI=1S/C23H35N3O2S/c1-2-3-4-5-6-7-8-9-10-11-15-18-20(19-16-13-12-14-17-19)24-22-21(23(27)28)25-26-29-22/h12-14,16-17,20,24H,2-11,15,18H2,1H3,(H,27,28)


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