1-(3-bromophenyl)-3-[2-[[2-(diethylamino)-6-methyl-pyrimidin-4-yl]amino]ethyl]thiourea

Systemtic Name: 1-(3-bromophenyl)-3-[2-[[2-(diethylamino)-6-methyl-pyrimidin-4-yl]amino]ethyl]thiourea Openeye Name: 1-(3-bromophenyl)-3-[2-[[2-(diethylamino)-6-methyl-pyrimidin-4-yl]amino]ethyl]thiourea CAS Name: 1-(3-bromophenyl)-3-[2-[[2-(diethylamino)-6-methyl-4-pyrimidinyl]amino]ethyl]thiourea IUPAC Name: 1-(3-bromophenyl)-3-[2-[[2-(diethylamino)-6-methylpyrimidin-4-yl]amino]ethyl]thiourea Traditional Name: 1-(3-bromophenyl)-3-[2-[[2-(diethylamino)-6-methyl-pyrimidin-4-yl]amino]ethyl]thiourea Formula: C18H25BrN6S MolecularWeight: 437.4003

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=CC(=N1)NCCNC(=S)NC2=CC(=CC=C2)Br)C

Isomeric SMILES

CCN(CC)C1=NC(=CC(=N1)NCCNC(=S)NC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C18H25BrN6S/c1-4-25(5-2)17-22-13(3)11-16(24-17)20-9-10-21-18(26)23-15-8-6-7-14(19)12-15/h6-8,11-12H,4-5,9-10H2,1-3H3,(H,20,22,24)(H2,21,23,26)