1-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-3-[(2R)-2-methylheptyl]thiourea

Systemtic Name: 1-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-3-[(2R)-2-methylheptyl]thiourea Openeye Name: 1-[(4-chloro-2-nitro-benzoyl)amino]-3-[(2R)-2-methylheptyl]thiourea CAS Name: 1-[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]-3-[(2R)-2-methylheptyl]thiourea IUPAC Name: 1-[(4-chloro-2-nitrobenzoyl)amino]-3-[(2R)-2-methylheptyl]thiourea Traditional Name: 1-[(4-chloro-2-nitro-benzoyl)amino]-3-[(2R)-2-methylheptyl]thiourea Formula: C16H23ClN4O3S MolecularWeight: 386.89682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCC[C@@H](C)CNC(=S)NNC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H23ClN4O3S/c1-3-4-5-6-11(2)10-18-16(25)20-19-15(22)13-8-7-12(17)9-14(13)21(23)24/h7-9,11H,3-6,10H2,1-2H3,(H,19,22)(H2,18,20,25)/t11-/m1/s1