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

Systemtic Name: 1-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-3-cyclopentyl-thiourea Openeye Name: 1-[[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]amino]-3-cyclopentyl-thiourea CAS Name: 1-[[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]amino]-3-cyclopentylthiourea IUPAC Name: 1-[[2-(4-bromo-2-methylphenyl)sulfanylacetyl]amino]-3-cyclopentylthiourea Traditional Name: 1-[[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]amino]-3-cyclopentyl-thiourea Formula: C15H20BrN3OS2 MolecularWeight: 402.3728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NNC(=S)NC2CCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NNC(=S)NC2CCCC2

InChI

InChI=1S/C15H20BrN3OS2/c1-10-8-11(16)6-7-13(10)22-9-14(20)18-19-15(21)17-12-4-2-3-5-12/h6-8,12H,2-5,9H2,1H3,(H,18,20)(H2,17,19,21)