1-[(2R)-butan-2-yl]-1-[(2S)-butan-2-yl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[(2R)-butan-2-yl]-1-[(2S)-butan-2-yl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 3-(2-methoxy-4-nitro-phenyl)-1-[(1R)-1-methylpropyl]-1-[(1S)-1-methylpropyl]thiourea CAS Name: 1-[(2R)-butan-2-yl]-1-[(2S)-butan-2-yl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[(2R)-butan-2-yl]-1-[(2S)-butan-2-yl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 3-(2-methoxy-4-nitro-phenyl)-1-[(1R)-1-methylpropyl]-1-[(1S)-1-methylpropyl]thiourea Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)N([C@@H](C)CC)C(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C16H25N3O3S/c1-6-11(3)18(12(4)7-2)16(23)17-14-9-8-13(19(20)21)10-15(14)22-5/h8-12H,6-7H2,1-5H3,(H,17,23)/t11-,12+