1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-homoveratryl-3-(3-nitrophenyl)thiourea Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC(=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC(=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H19N3O4S/c1-23-15-7-6-12(10-16(15)24-2)8-9-18-17(25)19-13-4-3-5-14(11-13)20(21)22/h3-7,10-11H,8-9H2,1-2H3,(H2,18,19,25)