1-[(4-butoxy-3-methoxy-phenyl)carbonylamino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(4-butoxy-3-methoxy-phenyl)carbonylamino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(4-butoxy-3-methoxy-benzoyl)amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[(4-butoxy-3-methoxyphenyl)-oxomethyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(4-butoxy-3-methoxybenzoyl)amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(4-butoxy-3-methoxy-benzoyl)amino]-3-(4-nitrophenyl)thiourea Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N4O5S/c1-3-4-11-28-16-10-5-13(12-17(16)27-2)18(24)21-22-19(29)20-14-6-8-15(9-7-14)23(25)26/h5-10,12H,3-4,11H2,1-2H3,(H,21,24)(H2,20,22,29)