1-(4-bromanyl-2-methyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea

Systemtic Name: 1-(4-bromanyl-2-methyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea Openeye Name: 1-(4-bromo-2-methyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea CAS Name: 1-(4-bromo-2-methylphenyl)-3-[3-(dimethylamino)propyl]thiourea IUPAC Name: 1-(4-bromo-2-methylphenyl)-3-[3-(dimethylamino)propyl]thiourea Traditional Name: 1-(4-bromo-2-methyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea Formula: C13H20BrN3S MolecularWeight: 330.287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=S)NCCCN(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=S)NCCCN(C)C

InChI

InChI=1S/C13H20BrN3S/c1-10-9-11(14)5-6-12(10)16-13(18)15-7-4-8-17(2)3/h5-6,9H,4,7-8H2,1-3H3,(H2,15,16,18)