1-(2-chloranyl-5-nitro-phenyl)-3-[(2S)-2-(diethylamino)-2-phenyl-ethyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[(2S)-2-(diethylamino)-2-phenyl-ethyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[(2S)-2-(diethylamino)-2-phenyl-ethyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[(2S)-2-(diethylamino)-2-phenylethyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[(2S)-2-(diethylamino)-2-phenylethyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[(2S)-2-(diethylamino)-2-phenyl-ethyl]thiourea Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)[C@H](CNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=CC=CC=C2

InChI

InChI=1S/C19H23ClN4O2S/c1-3-23(4-2)18(14-8-6-5-7-9-14)13-21-19(27)22-17-12-15(24(25)26)10-11-16(17)20/h5-12,18H,3-4,13H2,1-2H3,(H2,21,22,27)/t18-/m1/s1