1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)OCC

InChI

InChI=1S/C20H25N3O5S/c1-4-27-17-9-6-14(12-19(17)28-5-2)10-11-21-20(29)22-16-8-7-15(23(24)25)13-18(16)26-3/h6-9,12-13H,4-5,10-11H2,1-3H3,(H2,21,22,29)