3-(2-chloranyl-5-nitro-phenyl)-1-[[4-(diethylamino)phenyl]methyl]-1-methyl-thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-[[4-(diethylamino)phenyl]methyl]-1-methyl-thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-[[4-(diethylamino)phenyl]methyl]-1-methyl-thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-[[4-(diethylamino)phenyl]methyl]-1-methylthiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-[[4-(diethylamino)phenyl]methyl]-1-methylthiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-[4-(diethylamino)benzyl]-1-methyl-thiourea Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CN(C)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CN(C)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H23ClN4O2S/c1-4-23(5-2)15-8-6-14(7-9-15)13-22(3)19(27)21-18-12-16(24(25)26)10-11-17(18)20/h6-12H,4-5,13H2,1-3H3,(H,21,27)