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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(diethylamino)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(diethylamino)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(diethylamino)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(diethylamino)phenyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(diethylamino)phenyl]thiourea Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2S/c1-3-21(4-2)15-8-5-13(6-9-15)19-18(24)20-14-7-10-16-17(11-14)23-12-22-16/h5-11H,3-4,12H2,1-2H3,(H2,19,20,24)