1-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[(4-ethoxy-3-nitro-benzoyl)amino]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(4-ethoxy-3-nitrobenzoyl)amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[(4-ethoxy-3-nitro-benzoyl)amino]-3-p-cumenyl-thiourea Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S/c1-4-27-17-10-7-14(11-16(17)23(25)26)18(24)21-22-19(28)20-15-8-5-13(6-9-15)12(2)3/h5-12H,4H2,1-3H3,(H,21,24)(H2,20,22,28)