1-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[(4-ethoxy-3-nitro-benzoyl)amino]-3-isopentyl-thiourea CAS Name: 1-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[(4-ethoxy-3-nitrobenzoyl)amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[(4-ethoxy-3-nitro-benzoyl)amino]-3-isoamyl-thiourea Formula: C15H22N4O4S MolecularWeight: 354.42458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NNC(=S)NCCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NNC(=S)NCCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H22N4O4S/c1-4-23-13-6-5-11(9-12(13)19(21)22)14(20)17-18-15(24)16-8-7-10(2)3/h5-6,9-10H,4,7-8H2,1-3H3,(H,17,20)(H2,16,18,24)