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4-[5-[3-(carbamothioylamino)phenoxy]pentoxy]benzoic acid

4-[5-[3-(carbamothioylamino)phenoxy]pentoxy]benzoic acid

Systemtic Name:4-[5-[3-(carbamothioylamino)phenoxy]pentoxy]benzoic acid
Openeye Name:4-[5-[3-(carbamothioylamino)phenoxy]pentoxy]benzoic acid
CAS Name:4-[5-[3-(carbamothioylamino)phenoxy]pentoxy]benzoic acid
IUPAC Name:4-[5-[3-(carbamothioylamino)phenoxy]pentoxy]benzoic acid
Traditional Name:4-[5-(3-thioureidophenoxy)pentoxy]benzoic acid
Formula: C19H22N2O4S
MolecularWeight: 374.45398
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCOC2=CC=C(C=C2)C(=O)O)NC(=S)N


Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCOC2=CC=C(C=C2)C(=O)O)NC(=S)N


InChI

InChI=1S/C19H22N2O4S/c20-19(26)21-15-5-4-6-17(13-15)25-12-3-1-2-11-24-16-9-7-14(8-10-16)18(22)23/h4-10,13H,1-3,11-12H2,(H,22,23)(H3,20,21,26)


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