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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(diethylamino)phenyl]carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(diethylamino)benzoyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[[[4-(diethylamino)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(diethylamino)benzoyl]amino]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(diethylamino)benzoyl]amino]thiourea Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N4O3S/c1-3-23(4-2)15-8-5-13(6-9-15)18(24)21-22-19(27)20-14-7-10-16-17(11-14)26-12-25-16/h5-11H,3-4,12H2,1-2H3,(H,21,24)(H2,20,22,27)