1-[(3,4-diethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(3,4-diethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(3,4-diethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(3,4-diethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(3,4-diethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-(3,4-diethoxybenzyl)-3-(4-nitrophenyl)thiourea Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O4S/c1-3-24-16-10-5-13(11-17(16)25-4-2)12-19-18(26)20-14-6-8-15(9-7-14)21(22)23/h5-11H,3-4,12H2,1-2H3,(H2,19,20,26)