1-[[2-(dimethylamino)-5-nitro-phenyl]carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-[[2-(dimethylamino)-5-nitro-phenyl]carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[[2-(dimethylamino)-5-nitro-benzoyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[[2-(dimethylamino)-5-nitrobenzoyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[[2-(dimethylamino)-5-nitro-benzoyl]amino]-3-p-anisyl-thiourea Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NNC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NNC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H21N5O4S/c1-22(2)16-9-6-13(23(25)26)10-15(16)17(24)20-21-18(28)19-11-12-4-7-14(27-3)8-5-12/h4-10H,11H2,1-3H3,(H,20,24)(H2,19,21,28)