1-(2-chloranyl-5-nitro-phenyl)-3-prop-2-enyl-thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(2-chloro-5-nitro-phenyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-prop-2-enylthiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(2-chloro-5-nitro-phenyl)thiourea Formula: C10H10ClN3O2S MolecularWeight: 271.7233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C10H10ClN3O2S/c1-2-5-12-10(17)13-9-6-7(14(15)16)3-4-8(9)11/h2-4,6H,1,5H2,(H2,12,13,17)