1-[(2S)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(2S)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(2S)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(2S)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(2S)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(2S)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(4-nitrophenyl)thiourea Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=S)NC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2OC

Isomeric SMILES

CN(C)[C@H](CNC(=S)NC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2OC

InChI

InChI=1S/C18H22N4O3S/c1-21(2)16(15-6-4-5-7-17(15)25-3)12-19-18(26)20-13-8-10-14(11-9-13)22(23)24/h4-11,16H,12H2,1-3H3,(H2,19,20,26)/t16-/m1/s1