1-(1,3-benzodioxol-5-yl)-3-[4-(dipropylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(dipropylsulfamoyl)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(dipropylsulfamoyl)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(dipropylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(dipropylsulfamoyl)phenyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(dipropylsulfamoyl)phenyl]thiourea Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H25N3O4S2/c1-3-11-23(12-4-2)29(24,25)17-8-5-15(6-9-17)21-20(28)22-16-7-10-18-19(13-16)27-14-26-18/h5-10,13H,3-4,11-12,14H2,1-2H3,(H2,21,22,28)