1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-nitrophenyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-nitrophenyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-nitrophenyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-(4-nitrophenyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-nitrophenyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-nitrophenyl)-1-(2-thenyl)thiourea Formula: C19H25N4O3S2+ MolecularWeight: 421.5568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN(CC2=CC=CS2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCCN(CC2=CC=CS2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O3S2/c24-23(25)17-6-4-16(5-7-17)20-19(27)22(15-18-3-1-14-28-18)9-2-8-21-10-12-26-13-11-21/h1,3-7,14H,2,8-13,15H2,(H,20,27)/p+1