3-(2-chloranyl-5-nitro-phenyl)-1,1-bis(3-methylbutyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1,1-bis(3-methylbutyl)thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1,1-diisopentyl-thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1,1-bis(3-methylbutyl)thiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1,1-bis(3-methylbutyl)thiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1,1-diisoamyl-thiourea Formula: C17H26ClN3O2S MolecularWeight: 371.92524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)C(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CCN(CCC(C)C)C(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H26ClN3O2S/c1-12(2)7-9-20(10-8-13(3)4)17(24)19-16-11-14(21(22)23)5-6-15(16)18/h5-6,11-13H,7-10H2,1-4H3,(H,19,24)