1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3,4-dimethylphenyl)thiourea

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3,4-dimethylphenyl)thiourea Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C19H23N3O4S/c1-12-5-6-15(9-13(12)2)21-19(27)20-8-7-14-10-17(25-3)18(26-4)11-16(14)22(23)24/h5-6,9-11H,7-8H2,1-4H3,(H2,20,21,27)