4-(4-phenyl-2-sulfanyl-phenoxy)butan-2-ylcarbamic acid

Systemtic Name: 4-(4-phenyl-2-sulfanyl-phenoxy)butan-2-ylcarbamic acid Openeye Name: [1-methyl-3-(4-phenyl-2-sulfanyl-phenoxy)propyl]carbamic acid CAS Name: 4-(2-mercapto-4-phenylphenoxy)butan-2-ylcarbamic acid IUPAC Name: 4-(4-phenyl-2-sulfanylphenoxy)butan-2-ylcarbamic acid Traditional Name: [3-(2-mercapto-4-phenyl-phenoxy)-1-methyl-propyl]carbamic acid Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=C(C=C(C=C1)C2=CC=CC=C2)S)NC(=O)O

Isomeric SMILES

CC(CCOC1=C(C=C(C=C1)C2=CC=CC=C2)S)NC(=O)O

InChI

InChI=1S/C17H19NO3S/c1-12(18-17(19)20)9-10-21-15-8-7-14(11-16(15)22)13-5-3-2-4-6-13/h2-8,11-12,18,22H,9-10H2,1H3,(H,19,20)