3-(2-methylprop-2-enyl)-1-[(4-nitrophenyl)methyl]-1-propyl-thiourea

Systemtic Name: 3-(2-methylprop-2-enyl)-1-[(4-nitrophenyl)methyl]-1-propyl-thiourea Openeye Name: 3-(2-methylallyl)-1-[(4-nitrophenyl)methyl]-1-propyl-thiourea CAS Name: 3-(2-methylprop-2-enyl)-1-[(4-nitrophenyl)methyl]-1-propylthiourea IUPAC Name: 3-(2-methylprop-2-enyl)-1-[(4-nitrophenyl)methyl]-1-propylthiourea Traditional Name: 3-(2-methylallyl)-1-(4-nitrobenzyl)-1-propyl-thiourea Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)[N+](=O)[O-])C(=S)NCC(=C)C

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)[N+](=O)[O-])C(=S)NCC(=C)C

InChI

InChI=1S/C15H21N3O2S/c1-4-9-17(15(21)16-10-12(2)3)11-13-5-7-14(8-6-13)18(19)20/h5-8H,2,4,9-11H2,1,3H3,(H,16,21)