1-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-3-(3-methoxypropyl)-1-methyl-thiourea

Systemtic Name: 1-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-3-(3-methoxypropyl)-1-methyl-thiourea Openeye Name: 1-[[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]amino]-3-(3-methoxypropyl)-1-methyl-thiourea CAS Name: 1-[[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]amino]-3-(3-methoxypropyl)-1-methylthiourea IUPAC Name: 1-[[2-(4-bromo-2-methylphenyl)sulfanylacetyl]amino]-3-(3-methoxypropyl)-1-methylthiourea Traditional Name: 1-[[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]amino]-3-(3-methoxypropyl)-1-methyl-thiourea Formula: C15H22BrN3O2S2 MolecularWeight: 420.38808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NN(C)C(=S)NCCCOC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NN(C)C(=S)NCCCOC

InChI

InChI=1S/C15H22BrN3O2S2/c1-11-9-12(16)5-6-13(11)23-10-14(20)18-19(2)15(22)17-7-4-8-21-3/h5-6,9H,4,7-8,10H2,1-3H3,(H,17,22)(H,18,20)