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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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