1-[(5-ethoxy-4-methoxy-2-nitro-phenyl)carbonylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(5-ethoxy-4-methoxy-2-nitro-phenyl)carbonylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(5-ethoxy-4-methoxy-2-nitro-benzoyl)amino]thiourea CAS Name: 1-[[(5-ethoxy-4-methoxy-2-nitrophenyl)-oxomethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(5-ethoxy-4-methoxy-2-nitrobenzoyl)amino]thiourea Traditional Name: 1-benzyl-3-[(5-ethoxy-4-methoxy-2-nitro-benzoyl)amino]thiourea Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NNC(=S)NCC2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NNC(=S)NCC2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H20N4O5S/c1-3-27-16-9-13(14(22(24)25)10-15(16)26-2)17(23)20-21-18(28)19-11-12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3,(H,20,23)(H2,19,21,28)