1-(3-methoxypropyl)-3-[(2-nitro-4-sulfamoyl-phenyl)amino]thiourea

Systemtic Name: 1-(3-methoxypropyl)-3-[(2-nitro-4-sulfamoyl-phenyl)amino]thiourea Openeye Name: 1-(3-methoxypropyl)-3-(2-nitro-4-sulfamoyl-anilino)thiourea CAS Name: 1-(3-methoxypropyl)-3-(2-nitro-4-sulfamoylanilino)thiourea IUPAC Name: 1-(3-methoxypropyl)-3-(2-nitro-4-sulfamoylanilino)thiourea Traditional Name: 1-(3-methoxypropyl)-3-(2-nitro-4-sulfamoyl-anilino)thiourea Formula: C11H17N5O5S2 MolecularWeight: 363.41318

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

COCCCNC(=S)NNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H17N5O5S2/c1-21-6-2-5-13-11(22)15-14-9-4-3-8(23(12,19)20)7-10(9)16(17)18/h3-4,7,14H,2,5-6H2,1H3,(H2,12,19,20)(H2,13,15,22)