1-[(Z)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-[(Z)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[(Z)-(2-chloro-5-nitro-phenyl)methyleneamino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[(Z)-(2-chloro-5-nitrophenyl)methylideneamino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[(Z)-(2-chloro-5-nitrophenyl)methylideneamino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[(Z)-(2-chloro-5-nitro-benzylidene)amino]-3-(3-ethoxypropyl)thiourea Formula: C13H17ClN4O3S MolecularWeight: 344.81708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NN=CC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCOCCCNC(=S)N/N=C\C1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H17ClN4O3S/c1-2-21-7-3-6-15-13(22)17-16-9-10-8-11(18(19)20)4-5-12(10)14/h4-5,8-9H,2-3,6-7H2,1H3,(H2,15,17,22)/b16-9-