1-[1,2-bis(oxidanyl)-3-propanoyl-indol-6-yl]-3-(4-sulfanylphenyl)urea

Systemtic Name: 1-[1,2-bis(oxidanyl)-3-propanoyl-indol-6-yl]-3-(4-sulfanylphenyl)urea Openeye Name: 1-(1,2-dihydroxy-3-propanoyl-indol-6-yl)-3-(4-sulfanylphenyl)urea CAS Name: 1-[1,2-dihydroxy-3-(1-oxopropyl)-6-indolyl]-3-(4-mercaptophenyl)urea IUPAC Name: 1-(1,2-dihydroxy-3-propanoylindol-6-yl)-3-(4-sulfanylphenyl)urea Traditional Name: 1-(1,2-dihydroxy-3-propionyl-indol-6-yl)-3-(4-mercaptophenyl)urea Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)S)O)O

Isomeric SMILES

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)S)O)O

InChI

InChI=1S/C18H17N3O4S/c1-2-15(22)16-13-8-5-11(9-14(13)21(25)17(16)23)20-18(24)19-10-3-6-12(26)7-4-10/h3-9,23,25-26H,2H2,1H3,(H2,19,20,24)