1-(5-chloranyl-2-nitro-phenyl)-3-phenethyl-thiourea

Systemtic Name: 1-(5-chloranyl-2-nitro-phenyl)-3-phenethyl-thiourea Openeye Name: 1-(5-chloro-2-nitro-phenyl)-3-phenethyl-thiourea CAS Name: 1-(5-chloro-2-nitrophenyl)-3-phenethylthiourea IUPAC Name: 1-(5-chloro-2-nitrophenyl)-3-phenethylthiourea Traditional Name: 1-(5-chloro-2-nitro-phenyl)-3-phenethyl-thiourea Formula: C15H14ClN3O2S MolecularWeight: 335.80856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14ClN3O2S/c16-12-6-7-14(19(20)21)13(10-12)18-15(22)17-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,17,18,22)