1-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-3-(4-nitrophenyl)thiourea Formula: C19H23N4O3S+ MolecularWeight: 387.47592

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O3S/c24-23(25)18-7-5-17(6-8-18)21-19(27)20-13-15-3-1-2-4-16(15)14-22-9-11-26-12-10-22/h1-8H,9-14H2,(H2,20,21,27)/p+1