1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholinosulfonylphenyl)thiourea Formula: C18H19N3O5S2 MolecularWeight: 421.49056

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19N3O5S2/c22-28(23,21-7-9-24-10-8-21)15-4-1-13(2-5-15)19-18(27)20-14-3-6-16-17(11-14)26-12-25-16/h1-6,11H,7-10,12H2,(H2,19,20,27)